N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide

C12H16N2O — CID 170583156

IUPACN-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide
SMILESCCCC(=O)NC1CCc2cccnc21
InChIInChI=1S/C12H16N2O/c1-2-4-11(15)14-10-7-6-9-5-3-8-13-12(9)10/h3,5,8,10H,2,4,6-7H2,1H3,(H,14,15)
InChIKeyDAROVXZOUBYTLA-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.99
Rot. Bonds3

About N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide

N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide (PubChem CID 170583156) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide.

Molecular Properties

Compound NameN-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide
PubChem CID170583156
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC NameN-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide
SMILESCCCC(=O)NC1CCc2cccnc21
InChIInChI=1S/C12H16N2O/c1-2-4-11(15)14-10-7-6-9-5-3-8-13-12(9)10/h3,5,8,10H,2,4,6-7H2,1H3,(H,14,15)
InChIKeyDAROVXZOUBYTLA-UHFFFAOYSA-N
XLogP1.99
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(8R)-5,6,7,8-tetrahydroquinolin-8-yl]propanamide
CID 165447452
ethyl 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propanoate
CID 102773602
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-(2-fluoroethyl)urea
CID 25052272
3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-N-propan-2-ylpropanamide
CID 102774214
N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide
CID 102772462
2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol
CID 102772845
2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-2-methylpropane-1,3-diol
CID 102774114
N-octan-4-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 114138079
N-[(1S)-2,3-dihydro-1H-inden-1-yl]dodecanamide
CID 23624796
2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-3-methylbutan-1-ol
CID 102773952
2-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)pyrazol-1-yl]-N-methylacetamide
CID 102773495
N-(4-pentylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 102772729

Frequently Asked Questions

What is the IUPAC name of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide?
The IUPAC name of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide (CID 170583156) is N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide.
What is the SMILES notation for N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide?
The canonical SMILES for N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide is CCCC(=O)NC1CCc2cccnc21.
What is the InChIKey of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide?
The InChIKey is DAROVXZOUBYTLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-2-4-11(15)14-10-7-6-9-5-3-8-13-12(9)10/h3,5,8,10H,2,4,6-7H2,1H3,(H,14,15).
What are the key properties of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide?
N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide has a molecular weight of 204.27 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide is sourced from PubChem (CID 170583156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).