N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine

C15H25N3 — CID 65415250

IUPACN-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine
SMILESCc1cc(CNC(C)C)nc(C2CCC(C)C2)n1
InChIInChI=1S/C15H25N3/c1-10(2)16-9-14-8-12(4)17-15(18-14)13-6-5-11(3)7-13/h8,10-11,13,16H,5-7,9H2,1-4H3
InChIKeyLIGZAKXELQKPLL-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.19
Rot. Bonds4

About N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine

N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine (PubChem CID 65415250) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine
PubChem CID65415250
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine
SMILESCc1cc(CNC(C)C)nc(C2CCC(C)C2)n1
InChIInChI=1S/C15H25N3/c1-10(2)16-9-14-8-12(4)17-15(18-14)13-6-5-11(3)7-13/h8,10-11,13,16H,5-7,9H2,1-4H3
InChIKeyLIGZAKXELQKPLL-UHFFFAOYSA-N
XLogP3.19
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[6-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-yl]methyl]propan-2-amine
CID 65400572
N-[[2-(3-ethylcyclohexyl)-6-methylpyrimidin-4-yl]methyl]propan-2-amine
CID 65415249
N-[[6-methyl-2-(oxolan-2-yl)pyrimidin-4-yl]methyl]propan-2-amine
CID 65328783
2-methoxy-N-[[6-methyl-2-(3-methylcyclohexyl)pyrimidin-4-yl]methyl]ethanamine
CID 62745005
N-[(2-cyclobutyl-6-methylpyrimidin-4-yl)methyl]propan-1-amine
CID 64986163
N-[[2-(cyclopropylmethoxy)-6-methylpyrimidin-4-yl]methyl]propan-2-amine
CID 114221213
N-[(2-cyclooctyl-6-methylpyrimidin-4-yl)methyl]propan-1-amine
CID 80609922
N,6-diethyl-2-(3-methylcyclopentyl)pyrimidin-4-amine
CID 65415234
N-[(2-cycloheptyl-6-methylpyrimidin-4-yl)methyl]cyclopropanamine
CID 65399678
N-[[6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-yl]methyl]propan-2-amine
CID 79664665
N-methyl-1-[6-methyl-2-(oxan-3-yl)pyrimidin-4-yl]methanamine
CID 65333930
N-[(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]propan-2-amine
CID 55114190

Frequently Asked Questions

What is the IUPAC name of N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine?
The IUPAC name of N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine (CID 65415250) is N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine is Cc1cc(CNC(C)C)nc(C2CCC(C)C2)n1.
What is the InChIKey of N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine?
The InChIKey is LIGZAKXELQKPLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-10(2)16-9-14-8-12(4)17-15(18-14)13-6-5-11(3)7-13/h8,10-11,13,16H,5-7,9H2,1-4H3.
What are the key properties of N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine?
N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine has a molecular weight of 247.39 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-methyl-2-(3-methylcyclopentyl)pyrimidin-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 65415250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).