1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine

C13H19N3 — CID 63320036

IUPAC1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine
SMILESNC1(c2nccc(C3CC3)n2)CCCCC1
InChIInChI=1S/C13H19N3/c14-13(7-2-1-3-8-13)12-15-9-6-11(16-12)10-4-5-10/h6,9-10H,1-5,7-8,14H2
InChIKeyNQGHNRGWIIIOKN-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.47
Rot. Bonds2

About 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine

1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine (PubChem CID 63320036) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine
PubChem CID63320036
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine
SMILESNC1(c2nccc(C3CC3)n2)CCCCC1
InChIInChI=1S/C13H19N3/c14-13(7-2-1-3-8-13)12-15-9-6-11(16-12)10-4-5-10/h6,9-10H,1-5,7-8,14H2
InChIKeyNQGHNRGWIIIOKN-UHFFFAOYSA-N
XLogP2.47
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-cyclopropylpyrimidin-2-yl)cyclopentan-1-amine
CID 63319473
1-(4-cyclopentyl-6-methylpyrimidin-2-yl)cyclopentan-1-amine
CID 63319946
[3-(4-cyclobutylpyrimidin-2-yl)oxetan-3-yl]methanamine
CID 116902990
[1-[4-(oxan-4-yl)pyrimidin-2-yl]cyclopropyl]methanamine
CID 116902577
1-[4-[bromo(difluoro)methyl]pyrimidin-2-yl]cyclobutan-1-amine;hydrochloride
CID 139018289
2-tert-butyl-4-cyclopropylpyrimidine
CID 58088107
2-(4-cyclobutylpyrimidin-2-yl)propan-2-amine
CID 116897705
1-(4-pyridin-2-ylpyrimidin-2-yl)cyclopropan-1-amine
CID 116903588
N-methyl-1-[1-[4-(oxan-4-yl)pyrimidin-2-yl]cyclobutyl]methanamine
CID 116902732
4-cyclopentyl-2-methylsulfanylpyrimidine
CID 70073291
[1-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]cyclobutyl]methanamine
CID 116902705
4-cyclobutyl-2-methylsulfonylpyrimidine
CID 82394382

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine?
The IUPAC name of 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine (CID 63320036) is 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine.
What is the SMILES notation for 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine?
The canonical SMILES for 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine is NC1(c2nccc(C3CC3)n2)CCCCC1.
What is the InChIKey of 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine?
The InChIKey is NQGHNRGWIIIOKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c14-13(7-2-1-3-8-13)12-15-9-6-11(16-12)10-4-5-10/h6,9-10H,1-5,7-8,14H2.
What are the key properties of 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine?
1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine has a molecular weight of 217.32 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopropylpyrimidin-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 63320036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).