2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one

C14H17NO — CID 115783784

IUPAC2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one
SMILESCC(C(=O)C1CCc2cccnc21)C1CC1
InChIInChI=1S/C14H17NO/c1-9(10-4-5-10)14(16)12-7-6-11-3-2-8-15-13(11)12/h2-3,8-10,12H,4-7H2,1H3
InChIKeyQIVPDYOZXFUHBU-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.73
Rot. Bonds3

About 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one

2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one (PubChem CID 115783784) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one.

Molecular Properties

Compound Name2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one
PubChem CID115783784
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one
SMILESCC(C(=O)C1CCc2cccnc21)C1CC1
InChIInChI=1S/C14H17NO/c1-9(10-4-5-10)14(16)12-7-6-11-3-2-8-15-13(11)12/h2-3,8-10,12H,4-7H2,1H3
InChIKeyQIVPDYOZXFUHBU-UHFFFAOYSA-N
XLogP2.73
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-methylbutan-1-one
CID 116594877
2-amino-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-1-one
CID 116554606
3-amino-2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-one
CID 116612266
2-butan-2-ylsulfanyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)ethanone
CID 79745420
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl(2,3-dihydro-1H-inden-2-yl)methanone
CID 79733260
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(5-methylthiophen-2-yl)methanone
CID 115783796
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 79740244
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(6-methyl-3-pyridinyl)methanone
CID 105115340
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[1-(2-methylpropyl)cyclopentyl]methanone
CID 115783694
2-amino-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-thiophen-2-ylethanone
CID 116601540
(4-chlorophenyl)-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanone
CID 79746175
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(4-ethylphenyl)methanone
CID 79746018

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one?
The IUPAC name of 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one (CID 115783784) is 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one.
What is the SMILES notation for 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one?
The canonical SMILES for 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one is CC(C(=O)C1CCc2cccnc21)C1CC1.
What is the InChIKey of 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one?
The InChIKey is QIVPDYOZXFUHBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-9(10-4-5-10)14(16)12-7-6-11-3-2-8-15-13(11)12/h2-3,8-10,12H,4-7H2,1H3.
What are the key properties of 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one?
2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one has a molecular weight of 215.30 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-one is sourced from PubChem (CID 115783784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).