2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C16H17N3 — CID 79977157

IUPAC2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESNc1nc(-c2ccccc2C2CC2)nc2c1CCC2
InChIInChI=1S/C16H17N3/c17-15-13-6-3-7-14(13)18-16(19-15)12-5-2-1-4-11(12)10-8-9-10/h1-2,4-5,10H,3,6-9H2,(H2,17,18,19)
InChIKeyOVSVTAYJNRJJOA-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.09
Rot. Bonds2

About 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 79977157) has the molecular formula C16H17N3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID79977157
Molecular FormulaC16H17N3
Molecular Weight251.33 g/mol
Exact Mass251.14
IUPAC Name2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESNc1nc(-c2ccccc2C2CC2)nc2c1CCC2
InChIInChI=1S/C16H17N3/c17-15-13-6-3-7-14(13)18-16(19-15)12-5-2-1-4-11(12)10-8-9-10/h1-2,4-5,10H,3,6-9H2,(H2,17,18,19)
InChIKeyOVSVTAYJNRJJOA-UHFFFAOYSA-N
XLogP3.09
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 79979881
6-cyclopropyl-2-(2-cyclopropylphenyl)-5-iodopyrimidin-4-amine
CID 79970668
2-(3-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 79979959
2-(2-cyclopropylphenyl)-7,8-dihydro-6H-quinazolin-5-one
CID 79971184
3-(2-cyclopropylphenyl)pyridine-2,6-diamine
CID 139370145
2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine
CID 83862354
2-(2-ethoxyphenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 63351905
2-N,2-N-dimethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine
CID 62192419
2-(2-methylfuran-3-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 113453444
2-(2-cyclopropylphenyl)-N-ethyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83193524
2-(2-phenyltriazol-4-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62202271
2-[4-bromo-2-(trifluoromethyl)phenyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62689493

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 79977157) is 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is Nc1nc(-c2ccccc2C2CC2)nc2c1CCC2.
What is the InChIKey of 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is OVSVTAYJNRJJOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3/c17-15-13-6-3-7-14(13)18-16(19-15)12-5-2-1-4-11(12)10-8-9-10/h1-2,4-5,10H,3,6-9H2,(H2,17,18,19).
What are the key properties of 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 251.33 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 79977157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).