5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one

C80H99FN12O4 — CID 159254493

IUPAC5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one
SMILESCN(C)C1(c2ccccc2)CC2(CN(c3ccc(C4CC4)cn3)C(=O)N2CC2CC2)C1.Cc1cc(C2CC2)ncc1N1CC2(CC(c3ccccc3)(N(C)C)C2)N(CC2(F)COC2)C1=O.Cc1cc(C2CC2)ncc1N1CC2(CC(c3ccccc3)(N(C)C)C2)N(CC2CC2)C1=O
InChIInChI=1S/C27H33FN4O2.C27H34N4O.C26H32N4O/c1-19-11-22(20-9-10-20)29-12-23(19)31-16-26(32(24(31)33)15-25(28)17-34-18-25)13-27(14-26,30(2)3)21-7-5-4-6-8-21;1-19-13-23(21-11-12-21)28-14-24(19)30-18-26(31(25(30)32)15-20-9-10-20)16-27(17-26,29(2)3)22-7-5-4-6-8-22;1-28(2)26(22-6-4-3-5-7-22)16-25(17-26)18-29(24(31)30(25)15-19-8-9-19)23-13-12-21(14-27-23)20-10-11-20/h4-8,11-12,20H,9-10,13-18H2,1-3H3;4-8,13-14,20-21H,9-12,15-18H2,1-3H3;3-7,12-14,19-20H,8-11,15-18H2,1-2H3
InChIKeyKVSGKDPLPZDPCB-UHFFFAOYSA-N
MW1311.75 g/mol
LogP13.75
Rot. Bonds18

About 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one

5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one (PubChem CID 159254493) has the molecular formula C80H99FN12O4 and a molecular weight of 1311.75 g/mol. Its IUPAC name is 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one.

Molecular Properties

Compound Name5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one
PubChem CID159254493
Molecular FormulaC80H99FN12O4
Molecular Weight1311.75 g/mol
Exact Mass1310.79
IUPAC Name5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one
SMILESCN(C)C1(c2ccccc2)CC2(CN(c3ccc(C4CC4)cn3)C(=O)N2CC2CC2)C1.Cc1cc(C2CC2)ncc1N1CC2(CC(c3ccccc3)(N(C)C)C2)N(CC2(F)COC2)C1=O.Cc1cc(C2CC2)ncc1N1CC2(CC(c3ccccc3)(N(C)C)C2)N(CC2CC2)C1=O
InChIInChI=1S/C27H33FN4O2.C27H34N4O.C26H32N4O/c1-19-11-22(20-9-10-20)29-12-23(19)31-16-26(32(24(31)33)15-25(28)17-34-18-25)13-27(14-26,30(2)3)21-7-5-4-6-8-21;1-19-13-23(21-11-12-21)28-14-24(19)30-18-26(31(25(30)32)15-20-9-10-20)16-27(17-26,29(2)3)22-7-5-4-6-8-22;1-28(2)26(22-6-4-3-5-7-22)16-25(17-26)18-29(24(31)30(25)15-19-8-9-19)23-13-12-21(14-27-23)20-10-11-20/h4-8,11-12,20H,9-10,13-18H2,1-3H3;4-8,13-14,20-21H,9-12,15-18H2,1-3H3;3-7,12-14,19-20H,8-11,15-18H2,1-2H3
InChIKeyKVSGKDPLPZDPCB-UHFFFAOYSA-N
XLogP13.75
TPSA128.27 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds18
Heavy Atoms97
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001311.75
LogP ≤ 513.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one with MolForge

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Launch Full Analysis

Related Compounds

5-(Cyclopropylmethyl)-2-(dimethylamino)-2-(3-fluorophenyl)-7-(2-methoxy-2-methylpropyl)-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-2-(dimethylamino)-2-phenyl-7-[5-(trifluoromethyl)-3-pyridinyl]-5,7-diazaspiro[3.4]octan-6-one;2-(dimethylamino)-2-phenyl-7-(2-pyridin-4-ylpyrimidin-5-yl)-5,7-diazaspiro[3.4]octan-6-one
CID 158249954
5-(Cyclopropylmethyl)-2-(dimethylamino)-2-(3-fluorophenyl)-7-(2-methoxy-2-methylpropyl)-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-2-(dimethylamino)-2-phenyl-7-[5-(trifluoromethyl)-3-pyridinyl]-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;2-(dimethylamino)-2-phenyl-7-(2-pyridin-4-ylpyrimidin-5-yl)-5,7-diazaspiro[3.4]octan-6-one
CID 161044888
3-[5-(Cyclopropylmethyl)-2-(dimethylamino)-2-(3-fluorophenyl)-6-oxo-5,7-diazaspiro[3.4]octan-7-yl]propanenitrile;3-[5-(cyclopropylmethyl)-2-(dimethylamino)-6-oxo-2-phenyl-5,7-diazaspiro[3.4]octan-7-yl]propanenitrile;5-(cyclopropylmethyl)-2-(dimethylamino)-2-phenyl-7-(2-pyridin-4-ylpyrimidin-5-yl)-5,7-diazaspiro[3.4]octan-6-one
CID 158236750
5-(Cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(6-cyclopropyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one
CID 159935076
7-[6-(Azetidin-1-yl)-4-methyl-3-pyridinyl]-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-[5-(cyclopropylmethyl)-2-(dimethylamino)-2-(3-fluorophenyl)-6-oxo-5,7-diazaspiro[3.4]octan-7-yl]-4-methylpyridine-2-carbonitrile;5-[2-(dimethylamino)-2-(3-fluorophenyl)-6-oxo-5,7-diazaspiro[3.4]octan-7-yl]-4-methylpyridine-2-carbonitrile
CID 161336654
7-[2-(Azetidin-1-yl)-4-methylpyrimidin-5-yl]-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-[5-(cyclopropylmethyl)-2-(dimethylamino)-2-(3-fluorophenyl)-6-oxo-5,7-diazaspiro[3.4]octan-7-yl]-4-methylpyridine-2-carbonitrile;5-[2-(dimethylamino)-2-(3-fluorophenyl)-6-oxo-5,7-diazaspiro[3.4]octan-7-yl]-4-methylpyridine-2-carbonitrile
CID 161889514

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one?
The IUPAC name of 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one (CID 159254493) is 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one.
What is the SMILES notation for 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one?
The canonical SMILES for 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one is CN(C)C1(c2ccccc2)CC2(CN(c3ccc(C4CC4)cn3)C(=O)N2CC2CC2)C1.Cc1cc(C2CC2)ncc1N1CC2(CC(c3ccccc3)(N(C)C)C2)N(CC2(F)COC2)C1=O.Cc1cc(C2CC2)ncc1N1CC2(CC(c3ccccc3)(N(C)C)C2)N(CC2CC2)C1=O.
What is the InChIKey of 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one?
The InChIKey is KVSGKDPLPZDPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33FN4O2.C27H34N4O.C26H32N4O/c1-19-11-22(20-9-10-20)29-12-23(19)31-16-26(32(24(31)33)15-25(28)17-34-18-25)13-27(14-26,30(2)3)21-7-5-4-6-8-21;1-19-13-23(21-11-12-21)28-14-24(19)30-18-26(31(25(30)32)15-20-9-10-20)16-27(17-26,29(2)3)22-7-5-4-6-8-22;1-28(2)26(22-6-4-3-5-7-22)16-25(17-26)18-29(24(31)30(25)15-19-8-9-19)23-13-12-21(14-27-23)20-10-11-20/h4-8,11-12,20H,9-10,13-18H2,1-3H3;4-8,13-14,20-21H,9-12,15-18H2,1-3H3;3-7,12-14,19-20H,8-11,15-18H2,1-2H3.
What are the key properties of 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one?
5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one has a molecular weight of 1311.75 g/mol, XLogP of 13.75, 18 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylmethyl)-7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;5-(cyclopropylmethyl)-7-(5-cyclopropyl-2-pyridinyl)-2-(dimethylamino)-2-phenyl-5,7-diazaspiro[3.4]octan-6-one;7-(6-cyclopropyl-4-methyl-3-pyridinyl)-2-(dimethylamino)-5-[(3-fluorooxetan-3-yl)methyl]-2-phenyl-5,7-diazaspiro[3.4]octan-6-one is sourced from PubChem (CID 159254493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).