(2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide

C16H23N3O2 — CID 124755099

IUPAC(2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide
SMILESC[C@@H](C(=O)Nc1ccccn1)N1CCOC2(CCCC2)C1
InChIInChI=1S/C16H23N3O2/c1-13(15(20)18-14-6-2-5-9-17-14)19-10-11-21-16(12-19)7-3-4-8-16/h2,5-6,9,13H,3-4,7-8,10-12H2,1H3,(H,17,18,20)/t13-/m0/s1
InChIKeyPPBRFBAAFKCPIW-ZDUSSCGKSA-N
MW289.38 g/mol
LogP2.05
Rot. Bonds3

About (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide

(2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide (PubChem CID 124755099) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide.

Molecular Properties

Compound Name(2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide
PubChem CID124755099
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name(2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide
SMILESC[C@@H](C(=O)Nc1ccccn1)N1CCOC2(CCCC2)C1
InChIInChI=1S/C16H23N3O2/c1-13(15(20)18-14-6-2-5-9-17-14)19-10-11-21-16(12-19)7-3-4-8-16/h2,5-6,9,13H,3-4,7-8,10-12H2,1H3,(H,17,18,20)/t13-/m0/s1
InChIKeyPPBRFBAAFKCPIW-ZDUSSCGKSA-N
XLogP2.05
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-morpholin-4-ylpiperidin-1-yl)-N-pyridin-2-ylpropanamide
CID 91830061
(2R)-N-(5-pyridin-2-yl-2-pyridinyl)-2-thiomorpholin-4-ylpropanamide
CID 97251269
4-methyl-1-propan-2-yl-N-pyridin-2-ylpiperidine-4-carboxamide
CID 134515265
2-chloro-N-pyridin-2-ylpropanamide
CID 16789014
formic acid;2-[4-(furan-3-carbonyl)-1,4-diazepan-1-yl]-N-pyridin-2-ylpropanamide
CID 154918994
4-acetyl-N-pyridin-2-ylpiperazine-1-carboxamide
CID 47267011
(2S)-2-[1-ethyl-3-(hydroxymethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]-N-pyridin-2-ylpropanamide
CID 124757250
2-(6-oxa-2-azaspiro[4.5]decan-2-yl)propanoic acid
CID 121202316
1-acetyl-4-phenyl-N-pyridin-2-ylpiperidine-4-carboxamide
CID 75460001
(2R)-2-[[4-(hydroxymethyl)oxan-4-yl]methyl-methylamino]-N-pyridin-2-ylpropanamide
CID 124753576
N-pyrimidin-2-yl-2-(2,2,6,6-tetramethylmorpholin-4-yl)propanamide
CID 136534692
(2R)-N-(5-chloro-2-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 25397777

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide?
The IUPAC name of (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide (CID 124755099) is (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide.
What is the SMILES notation for (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide?
The canonical SMILES for (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide is C[C@@H](C(=O)Nc1ccccn1)N1CCOC2(CCCC2)C1.
What is the InChIKey of (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide?
The InChIKey is PPBRFBAAFKCPIW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-13(15(20)18-14-6-2-5-9-17-14)19-10-11-21-16(12-19)7-3-4-8-16/h2,5-6,9,13H,3-4,7-8,10-12H2,1H3,(H,17,18,20)/t13-/m0/s1.
What are the key properties of (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide?
(2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide has a molecular weight of 289.38 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(6-oxa-9-azaspiro[4.5]decan-9-yl)-N-pyridin-2-ylpropanamide is sourced from PubChem (CID 124755099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).