(4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine

C15H17N3 — CID 83870489

IUPAC(4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine
SMILESCc1nc(-c2ccccc2)nc2c1C(CN)CC2
InChIInChI=1S/C15H17N3/c1-10-14-12(9-16)7-8-13(14)18-15(17-10)11-5-3-2-4-6-11/h2-6,12H,7-9,16H2,1H3
InChIKeyDKFYVNPNNMUCBH-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.44
Rot. Bonds2

About (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine

(4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine (PubChem CID 83870489) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine.

Molecular Properties

Compound Name(4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine
PubChem CID83870489
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name(4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine
SMILESCc1nc(-c2ccccc2)nc2c1C(CN)CC2
InChIInChI=1S/C15H17N3/c1-10-14-12(9-16)7-8-13(14)18-15(17-10)11-5-3-2-4-6-11/h2-6,12H,7-9,16H2,1H3
InChIKeyDKFYVNPNNMUCBH-UHFFFAOYSA-N
XLogP2.44
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,3,10-trimethyl-8-phenyl-7,9-diazatricyclo[4.4.0.02,4]deca-1(10),6,8-triene
CID 3436833
[2-(3-fluorophenyl)-4-methyl-5,6,7,8-tetrahydroquinazolin-6-yl]methanamine
CID 81424855
4,5,6-trimethyl-2-phenylpyrimidine
CID 21336303
3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine
CID 28916529
(2-methyl-4-propan-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine
CID 83861716
5-iodo-6-methyl-2-phenylpyrimidin-4-amine
CID 12795372
[2-(2,6-dimethyl-4-pyridinyl)-4-methyl-5,6,7,8-tetrahydroquinazolin-6-yl]methanamine
CID 107504552
[4-[4-methyl-6-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-yl]phenyl]methanamine
CID 172563770
4-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,5-diamine
CID 83870463
5-bromo-6-methyl-2-phenylpyrimidin-4-amine
CID 66304858
(1-tert-butyl-3-phenyl-4,5,6,7-tetrahydroindazol-4-yl)methanamine
CID 82593416
(4-methyl-2-thiophen-2-yl-5,6,7,8-tetrahydroquinazolin-6-yl)methanamine
CID 81424289

Frequently Asked Questions

What is the IUPAC name of (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine?
The IUPAC name of (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine (CID 83870489) is (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine.
What is the SMILES notation for (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine?
The canonical SMILES for (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine is Cc1nc(-c2ccccc2)nc2c1C(CN)CC2.
What is the InChIKey of (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine?
The InChIKey is DKFYVNPNNMUCBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-10-14-12(9-16)7-8-13(14)18-15(17-10)11-5-3-2-4-6-11/h2-6,12H,7-9,16H2,1H3.
What are the key properties of (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine?
(4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine has a molecular weight of 239.32 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl)methanamine is sourced from PubChem (CID 83870489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).