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

C9H14ClN3 — CID 55270015

IUPAC(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride
SMILESCc1nc(CN)c2c(n1)CCC2.Cl
InChIInChI=1S/C9H13N3.ClH/c1-6-11-8-4-2-3-7(8)9(5-10)12-6;/h2-5,10H2,1H3;1H
InChIKeyJOPIYERWCJFJMI-UHFFFAOYSA-N
MW199.69 g/mol
LogP1.15
Rot. Bonds1

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

(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride (PubChem CID 55270015) has the molecular formula C9H14ClN3 and a molecular weight of 199.69 g/mol. Its IUPAC name is (2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride.

Molecular Properties

Compound Name(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride
PubChem CID55270015
Molecular FormulaC9H14ClN3
Molecular Weight199.69 g/mol
Exact Mass199.09
IUPAC Name(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride
SMILESCc1nc(CN)c2c(n1)CCC2.Cl
InChIInChI=1S/C9H13N3.ClH/c1-6-11-8-4-2-3-7(8)9(5-10)12-6;/h2-5,10H2,1H3;1H
InChIKeyJOPIYERWCJFJMI-UHFFFAOYSA-N
XLogP1.15
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.69
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride?
The IUPAC name of (2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride (CID 55270015) is (2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride.
What is the SMILES notation for (2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride?
The canonical SMILES for (2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride is Cc1nc(CN)c2c(n1)CCC2.Cl.
What is the InChIKey of (2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride?
The InChIKey is JOPIYERWCJFJMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3.ClH/c1-6-11-8-4-2-3-7(8)9(5-10)12-6;/h2-5,10H2,1H3;1H.
What are the key properties of (2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride?
(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride has a molecular weight of 199.69 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine;hydrochloride is sourced from PubChem (CID 55270015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).