2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine

C13H19N3 — CID 84735082

IUPAC2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESc1nc(CC2CCCCN2)nc2c1CCC2
InChIInChI=1S/C13H19N3/c1-2-7-14-11(5-1)8-13-15-9-10-4-3-6-12(10)16-13/h9,11,14H,1-8H2
InChIKeyMDNKMGKHVHIHDI-UHFFFAOYSA-N
MW217.32 g/mol
LogP1.65
Rot. Bonds2

About 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine

2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine (PubChem CID 84735082) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine.

Molecular Properties

Compound Name2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
PubChem CID84735082
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESc1nc(CC2CCCCN2)nc2c1CCC2
InChIInChI=1S/C13H19N3/c1-2-7-14-11(5-1)8-13-15-9-10-4-3-6-12(10)16-13/h9,11,14H,1-8H2
InChIKeyMDNKMGKHVHIHDI-UHFFFAOYSA-N
XLogP1.65
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(piperidin-2-ylmethyl)-6,8-dihydro-5H-pyrano[3,4-d]pyrimidine
CID 105493342
5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 117231656
tert-butyl 2-(pyrrolidin-2-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate
CID 91368928
5-ethoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 117231619
2-(piperidin-2-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-5-ol
CID 117155534
5,6,7,8-tetrahydroquinazolin-2-ylmethanamine
CID 55265501
4-[3-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)propyl]aniline
CID 82481825
2-(2H-tetrazol-5-ylmethyl)piperidine
CID 84652779
4-(pyrrolidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 83848148
2-(piperidin-2-ylmethyl)-4,5,6,7-tetrahydro-1,3-benzothiazole
CID 115041792
2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-ylmethyl)piperidine
CID 117360963
N-(pyrrolidin-2-ylmethyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-2-amine
CID 83841695

Frequently Asked Questions

What is the IUPAC name of 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The IUPAC name of 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine (CID 84735082) is 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine.
What is the SMILES notation for 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The canonical SMILES for 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine is c1nc(CC2CCCCN2)nc2c1CCC2.
What is the InChIKey of 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The InChIKey is MDNKMGKHVHIHDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-2-7-14-11(5-1)8-13-15-9-10-4-3-6-12(10)16-13/h9,11,14H,1-8H2.
What are the key properties of 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine has a molecular weight of 217.32 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(piperidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine is sourced from PubChem (CID 84735082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).