(3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide

C20H30FN3O — CID 95891913

IUPAC(3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
SMILESCN1CC2(CCNCC2)C[C@@H]1C(=O)NC(C)(C)Cc1ccc(F)cc1
InChIInChI=1S/C20H30FN3O/c1-19(2,12-15-4-6-16(21)7-5-15)23-18(25)17-13-20(14-24(17)3)8-10-22-11-9-20/h4-7,17,22H,8-14H2,1-3H3,(H,23,25)/t17-/m1/s1
InChIKeyFPHSGANDHCWIJZ-QGZVFWFLSA-N
MW347.48 g/mol
LogP2.34
Rot. Bonds4

About (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide

(3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide (PubChem CID 95891913) has the molecular formula C20H30FN3O and a molecular weight of 347.48 g/mol. Its IUPAC name is (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
PubChem CID95891913
Molecular FormulaC20H30FN3O
Molecular Weight347.48 g/mol
Exact Mass347.24
IUPAC Name(3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
SMILESCN1CC2(CCNCC2)C[C@@H]1C(=O)NC(C)(C)Cc1ccc(F)cc1
InChIInChI=1S/C20H30FN3O/c1-19(2,12-15-4-6-16(21)7-5-15)23-18(25)17-13-20(14-24(17)3)8-10-22-11-9-20/h4-7,17,22H,8-14H2,1-3H3,(H,23,25)/t17-/m1/s1
InChIKeyFPHSGANDHCWIJZ-QGZVFWFLSA-N
XLogP2.34
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.48
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide?
The IUPAC name of (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide (CID 95891913) is (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide.
What is the SMILES notation for (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide?
The canonical SMILES for (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide is CN1CC2(CCNCC2)C[C@@H]1C(=O)NC(C)(C)Cc1ccc(F)cc1.
What is the InChIKey of (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide?
The InChIKey is FPHSGANDHCWIJZ-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H30FN3O/c1-19(2,12-15-4-6-16(21)7-5-15)23-18(25)17-13-20(14-24(17)3)8-10-22-11-9-20/h4-7,17,22H,8-14H2,1-3H3,(H,23,25)/t17-/m1/s1.
What are the key properties of (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide?
(3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide has a molecular weight of 347.48 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide is sourced from PubChem (CID 95891913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).