2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine

C15H24N4 — CID 80959929

IUPAC2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine
SMILESCNc1cc(N2CCCCCC2C)nc(C2CC2)n1
InChIInChI=1S/C15H24N4/c1-11-6-4-3-5-9-19(11)14-10-13(16-2)17-15(18-14)12-7-8-12/h10-12H,3-9H2,1-2H3,(H,16,17,18)
InChIKeyMPUYYFUQALLLOB-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.16
Rot. Bonds3

About 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine

2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine (PubChem CID 80959929) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine
PubChem CID80959929
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine
SMILESCNc1cc(N2CCCCCC2C)nc(C2CC2)n1
InChIInChI=1S/C15H24N4/c1-11-6-4-3-5-9-19(11)14-10-13(16-2)17-15(18-14)12-7-8-12/h10-12H,3-9H2,1-2H3,(H,16,17,18)
InChIKeyMPUYYFUQALLLOB-UHFFFAOYSA-N
XLogP3.16
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-N-ethyl-6-(2-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80967631
N-methyl-6-(2-methylazepan-1-yl)pyridin-2-amine
CID 80835819
2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine
CID 80967096
1-[2-cyclopropyl-6-(methylamino)pyrimidin-4-yl]-6-methylpiperidine-3-carboxamide
CID 80961032
2-cyclopropyl-N-methyl-6-morpholin-4-ylpyrimidin-4-amine
CID 80956626
2-cyclopropyl-N-methyl-6-(3,4,5-trimethylpiperazin-1-yl)pyrimidin-4-amine
CID 114541814
2-cyclopropyl-N-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-amine
CID 80955969
6-(8-azaspiro[4.5]decan-8-yl)-2-cyclopropyl-N-methylpyrimidin-4-amine
CID 80958988
2-cyclopropyl-4-(2-methylpiperidin-1-yl)-1H-pyrimidin-6-one
CID 137258814
[6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine
CID 80947173
1-[2-cyclopropyl-6-(methylamino)pyrimidin-4-yl]piperidine-4-carboxamide
CID 80957124
2-cyclopropyl-6-N-methyl-4-N-(2-methylcycloheptyl)pyrimidine-4,6-diamine
CID 80959584

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine (CID 80959929) is 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine is CNc1cc(N2CCCCCC2C)nc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine?
The InChIKey is MPUYYFUQALLLOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-11-6-4-3-5-9-19(11)14-10-13(16-2)17-15(18-14)12-7-8-12/h10-12H,3-9H2,1-2H3,(H,16,17,18).
What are the key properties of 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine?
2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine has a molecular weight of 260.38 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-methyl-6-(2-methylazepan-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 80959929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).