N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide

C22H32N4O4 — CID 58653386

IUPACN-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide
SMILESCOc1ccc(NC(C)=O)c(N2CCC[C@@]3(CCN(C4CCC(O)CC4)C3=O)C2)n1
InChIInChI=1S/C22H32N4O4/c1-15(27)23-18-8-9-19(30-2)24-20(18)25-12-3-10-22(14-25)11-13-26(21(22)29)16-4-6-17(28)7-5-16/h8-9,16-17,28H,3-7,10-14H2,1-2H3,(H,23,27)/t16?,17?,22-/m1/s1
InChIKeyCNEFNHAQRGRQFB-CNXQINBVSA-N
MW416.52 g/mol
LogP2.17
Rot. Bonds4

About N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide

N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide (PubChem CID 58653386) has the molecular formula C22H32N4O4 and a molecular weight of 416.52 g/mol. Its IUPAC name is N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide
PubChem CID58653386
Molecular FormulaC22H32N4O4
Molecular Weight416.52 g/mol
Exact Mass416.24
IUPAC NameN-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide
SMILESCOc1ccc(NC(C)=O)c(N2CCC[C@@]3(CCN(C4CCC(O)CC4)C3=O)C2)n1
InChIInChI=1S/C22H32N4O4/c1-15(27)23-18-8-9-19(30-2)24-20(18)25-12-3-10-22(14-25)11-13-26(21(22)29)16-4-6-17(28)7-5-16/h8-9,16-17,28H,3-7,10-14H2,1-2H3,(H,23,27)/t16?,17?,22-/m1/s1
InChIKeyCNEFNHAQRGRQFB-CNXQINBVSA-N
XLogP2.17
TPSA95.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.52
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide with MolForge

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Launch Full Analysis

Related Compounds

[2-[(5S)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]carbamic acid
CID 68751814
[2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl] N-ethylcarbamate
CID 90865215
ethyl N-[6-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-5-methoxy-3-pyridinyl]carbamate
CID 76677750
[6-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-5-methoxy-3-pyridinyl] carbamate
CID 67503941
methyl N-[5-fluoro-2-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]pyrimidin-4-yl]carbamate
CID 76677792
(5R)-9-(3-bromo-5-methyl-2-pyridinyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 58653270
[5-chloro-6-[(5S)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-3-pyridinyl]carbamic acid
CID 68750031
methyl N-[4-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-3-(trifluoromethyl)phenyl]carbamate
CID 58653373
9-(5-chloro-3-fluoro-2-pyridinyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 66722584
9-(5-fluoro-2-methylphenyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 66722375
N-[4-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]phenyl]methanesulfonamide
CID 58653318
(5R)-2-(4-hydroxycyclohexyl)-9-[2-(trifluoromethyl)quinazolin-4-yl]-2,9-diazaspiro[4.5]decan-1-one
CID 58653212

Frequently Asked Questions

What is the IUPAC name of N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide?
The IUPAC name of N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide (CID 58653386) is N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide.
What is the SMILES notation for N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide?
The canonical SMILES for N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide is COc1ccc(NC(C)=O)c(N2CCC[C@@]3(CCN(C4CCC(O)CC4)C3=O)C2)n1.
What is the InChIKey of N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide?
The InChIKey is CNEFNHAQRGRQFB-CNXQINBVSA-N. The full InChI is InChI=1S/C22H32N4O4/c1-15(27)23-18-8-9-19(30-2)24-20(18)25-12-3-10-22(14-25)11-13-26(21(22)29)16-4-6-17(28)7-5-16/h8-9,16-17,28H,3-7,10-14H2,1-2H3,(H,23,27)/t16?,17?,22-/m1/s1.
What are the key properties of N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide?
N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide has a molecular weight of 416.52 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-6-methoxy-3-pyridinyl]acetamide is sourced from PubChem (CID 58653386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).