1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine

C15H24N4 — CID 72932666

IUPAC1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine
SMILESCN(C)C1CCCN(c2cc(C3CC3)ncn2)CC1
InChIInChI=1S/C15H24N4/c1-18(2)13-4-3-8-19(9-7-13)15-10-14(12-5-6-12)16-11-17-15/h10-13H,3-9H2,1-2H3
InChIKeyIJZWEWLDMLADBR-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.27
Rot. Bonds3

About 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine

1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine (PubChem CID 72932666) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine.

Molecular Properties

Compound Name1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine
PubChem CID72932666
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine
SMILESCN(C)C1CCCN(c2cc(C3CC3)ncn2)CC1
InChIInChI=1S/C15H24N4/c1-18(2)13-4-3-8-19(9-7-13)15-10-14(12-5-6-12)16-11-17-15/h10-13H,3-9H2,1-2H3
InChIKeyIJZWEWLDMLADBR-UHFFFAOYSA-N
XLogP2.27
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]-N-methylmethanesulfonamide
CID 171335953
N-[1-(6-cyclopropylpyrimidin-4-yl)piperidin-4-yl]-N-methylcyclobutanecarboxamide
CID 171335566
1-(6-cyclopropylpyrimidin-4-yl)piperidin-4-ol
CID 126850200
4-cyclobutyl-6-(3-fluoropiperidin-1-yl)pyrimidine
CID 172880704
4-cyclobutyl-6-[4-(6-methoxypyrimidin-4-yl)piperazin-1-yl]pyrimidine
CID 146074366
2-[1-(6-cyclobutylpyrimidin-4-yl)piperidin-4-yl]-5-cyclopropyl-1,3,4-oxadiazole
CID 163348144
N-[1-(6-cyclopropylpyrimidin-4-yl)pyrrolidin-3-yl]-N-methylacetamide
CID 155974233
4-cyclobutyl-6-[4-(difluoromethyl)piperidin-1-yl]pyrimidine
CID 166602994
6-[3-(dimethylamino)piperidin-1-yl]pyrimidin-4-amine
CID 80856163
2-cyclopropyl-N-[1-(6-cyclopropylpyrimidin-4-yl)pyrrolidin-3-yl]-N-methylpyrimidin-4-amine
CID 172901438
1-(6-cyclobutylpyrimidin-4-yl)-4-methylsulfonyl-1,4-diazepane
CID 165435367
4-cyclopropyl-6-[3-(methylsulfanylmethyl)piperidin-1-yl]pyrimidine
CID 72839959

Frequently Asked Questions

What is the IUPAC name of 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine?
The IUPAC name of 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine (CID 72932666) is 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine.
What is the SMILES notation for 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine?
The canonical SMILES for 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine is CN(C)C1CCCN(c2cc(C3CC3)ncn2)CC1.
What is the InChIKey of 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine?
The InChIKey is IJZWEWLDMLADBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-18(2)13-4-3-8-19(9-7-13)15-10-14(12-5-6-12)16-11-17-15/h10-13H,3-9H2,1-2H3.
What are the key properties of 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine?
1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine has a molecular weight of 260.38 g/mol, XLogP of 2.27, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-cyclopropylpyrimidin-4-yl)-N,N-dimethylazepan-4-amine is sourced from PubChem (CID 72932666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).