[2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine

C15H25N5 — CID 65045663

IUPAC[2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine
SMILESCC1CCCC1(CN)N1CCN(c2ncccn2)CC1
InChIInChI=1S/C15H25N5/c1-13-4-2-5-15(13,12-16)20-10-8-19(9-11-20)14-17-6-3-7-18-14/h3,6-7,13H,2,4-5,8-12,16H2,1H3
InChIKeyCDQLTCITOLPJOJ-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.12
Rot. Bonds3

About [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine

[2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine (PubChem CID 65045663) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine
PubChem CID65045663
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name[2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine
SMILESCC1CCCC1(CN)N1CCN(c2ncccn2)CC1
InChIInChI=1S/C15H25N5/c1-13-4-2-5-15(13,12-16)20-10-8-19(9-11-20)14-17-6-3-7-18-14/h3,6-7,13H,2,4-5,8-12,16H2,1H3
InChIKeyCDQLTCITOLPJOJ-UHFFFAOYSA-N
XLogP1.12
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine
CID 24691066
[1-(4-cyclopropylpiperazin-1-yl)-2-methylcyclohexyl]methanamine
CID 61440866
[1-(4-methoxypiperidin-1-yl)-2-methylcyclohexyl]methanamine
CID 43372747
[3-(4-pyrimidin-2-ylpiperazin-1-yl)thian-3-yl]methanamine
CID 62872191
[1-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]cyclopentyl]methanamine
CID 62262303
azane;2-(4-methylpiperidin-1-yl)pyrimidine
CID 70283358
[1-(2,2-dimethylmorpholin-4-yl)-2-methylcyclohexyl]methanamine
CID 43592649
(2-amino-1-methylcyclopentyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 82765088
2-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine
CID 79569923
2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamine;dihydrochloride
CID 46736988
[3-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methanamine
CID 107105483
2-cyclopentyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 78768063

Frequently Asked Questions

What is the IUPAC name of [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine?
The IUPAC name of [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine (CID 65045663) is [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine.
What is the SMILES notation for [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine?
The canonical SMILES for [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine is CC1CCCC1(CN)N1CCN(c2ncccn2)CC1.
What is the InChIKey of [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine?
The InChIKey is CDQLTCITOLPJOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-13-4-2-5-15(13,12-16)20-10-8-19(9-11-20)14-17-6-3-7-18-14/h3,6-7,13H,2,4-5,8-12,16H2,1H3.
What are the key properties of [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine?
[2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine has a molecular weight of 275.40 g/mol, XLogP of 1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)cyclopentyl]methanamine is sourced from PubChem (CID 65045663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).