2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine

C12H11N3 — CID 157029881

IUPAC2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESc1ccc(-c2ncc3c(n2)CCC3)nc1
InChIInChI=1S/C12H11N3/c1-2-7-13-11(5-1)12-14-8-9-4-3-6-10(9)15-12/h1-2,5,7-8H,3-4,6H2
InChIKeyORXJPWUSXUYZBS-UHFFFAOYSA-N
MW197.24 g/mol
LogP2.03
Rot. Bonds1

About 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine

2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine (PubChem CID 157029881) has the molecular formula C12H11N3 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine.

Molecular Properties

Compound Name2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
PubChem CID157029881
Molecular FormulaC12H11N3
Molecular Weight197.24 g/mol
Exact Mass197.10
IUPAC Name2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESc1ccc(-c2ncc3c(n2)CCC3)nc1
InChIInChI=1S/C12H11N3/c1-2-7-13-11(5-1)12-14-8-9-4-3-6-10(9)15-12/h1-2,5,7-8H,3-4,6H2
InChIKeyORXJPWUSXUYZBS-UHFFFAOYSA-N
XLogP2.03
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-2-yl-7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 24931669
6-(5-chloro-2-pyridinyl)-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 121456045
3-pyridin-2-yl-5,6,7,8-tetrahydroquinoline
CID 10536433
1-(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-3,4-dihydro-2H-quinoline
CID 157029786
2-(3-bromophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 82489137
6-(3-fluoro-4-methoxy-2-pyridinyl)-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 121455953
CID 139150015
CID 139150015
trimethyl-(2-pyridin-2-yl-5,6,7,8-tetrahydroquinolin-3-yl)silane
CID 10493201
8-methylsulfanyl-2-pyridin-2-yl-5,6-dihydropyrimido[4,5-f]quinazoline
CID 54032488
2-pyridin-2-yl-7-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 24931585
2-hydroxy-4-(2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)benzoic acid
CID 121456158
2-[2-(trifluoromethyl)-4-pyridinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 177049801

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The IUPAC name of 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine (CID 157029881) is 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine.
What is the SMILES notation for 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The canonical SMILES for 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine is c1ccc(-c2ncc3c(n2)CCC3)nc1.
What is the InChIKey of 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The InChIKey is ORXJPWUSXUYZBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3/c1-2-7-13-11(5-1)12-14-8-9-4-3-6-10(9)15-12/h1-2,5,7-8H,3-4,6H2.
What are the key properties of 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine has a molecular weight of 197.24 g/mol, XLogP of 2.03, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine is sourced from PubChem (CID 157029881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).