N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide

C16H17N3O — CID 102772462

IUPACN-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC2CCc3cccnc32)cc1
InChIInChI=1S/C16H17N3O/c1-11(20)18-13-5-7-14(8-6-13)19-15-9-4-12-3-2-10-17-16(12)15/h2-3,5-8,10,15,19H,4,9H2,1H3,(H,18,20)
InChIKeyIKEQKYFSMOLHMQ-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.14
Rot. Bonds3

About N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide

N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide (PubChem CID 102772462) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide
PubChem CID102772462
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC NameN-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC2CCc3cccnc32)cc1
InChIInChI=1S/C16H17N3O/c1-11(20)18-13-5-7-14(8-6-13)19-15-9-4-12-3-2-10-17-16(12)15/h2-3,5-8,10,15,19H,4,9H2,1H3,(H,18,20)
InChIKeyIKEQKYFSMOLHMQ-UHFFFAOYSA-N
XLogP3.14
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)benzamide
CID 102772556
1-N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-N,4-N-diethylbenzene-1,4-diamine
CID 102772921
N-(4-pentylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 102772729
2-chloro-4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)benzamide
CID 102773264
2-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)pyrazol-1-yl]-N-methylacetamide
CID 102773495
N-(4-bromo-3-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 102773903
N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butanamide
CID 170583156
N-(4-bromo-3-nitrophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 102773966
N-(3-chloro-4-nitrophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine
CID 102774146
N-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1,3-benzothiazol-6-amine
CID 107803892
4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-N,3-dimethylbenzamide
CID 102773287
3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)benzonitrile
CID 102772599

Frequently Asked Questions

What is the IUPAC name of N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide?
The IUPAC name of N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide (CID 102772462) is N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide.
What is the SMILES notation for N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide?
The canonical SMILES for N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide is CC(=O)Nc1ccc(NC2CCc3cccnc32)cc1.
What is the InChIKey of N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide?
The InChIKey is IKEQKYFSMOLHMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-11(20)18-13-5-7-14(8-6-13)19-15-9-4-12-3-2-10-17-16(12)15/h2-3,5-8,10,15,19H,4,9H2,1H3,(H,18,20).
What are the key properties of N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide?
N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide has a molecular weight of 267.33 g/mol, XLogP of 3.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)phenyl]acetamide is sourced from PubChem (CID 102772462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).