2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide

C14H24N6O — CID 70981953

IUPAC2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide
SMILESCC(N)CNc1ncc(C(N)=O)c(NC2CCCCC2)n1
InChIInChI=1S/C14H24N6O/c1-9(15)7-17-14-18-8-11(12(16)21)13(20-14)19-10-5-3-2-4-6-10/h8-10H,2-7,15H2,1H3,(H2,16,21)(H2,17,18,19,20)
InChIKeyUAYBCKVPLZGCSH-UHFFFAOYSA-N
MW292.39 g/mol
LogP1.08
Rot. Bonds6

About 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide

2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide (PubChem CID 70981953) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide
PubChem CID70981953
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC Name2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide
SMILESCC(N)CNc1ncc(C(N)=O)c(NC2CCCCC2)n1
InChIInChI=1S/C14H24N6O/c1-9(15)7-17-14-18-8-11(12(16)21)13(20-14)19-10-5-3-2-4-6-10/h8-10H,2-7,15H2,1H3,(H2,16,21)(H2,17,18,19,20)
InChIKeyUAYBCKVPLZGCSH-UHFFFAOYSA-N
XLogP1.08
TPSA118.95 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 51.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

2-(cyclohexylamino)-4-(cyclopentylamino)pyrimidine-5-carboxamide
CID 71237540
2-(cyclohexylamino)-4-(propan-2-ylamino)pyrimidine-5-carboxamide
CID 71242271
2-(2-aminopropylamino)-4-(4-methylanilino)pyrimidine-5-carboxamide
CID 78119144
4-(cyclohexylamino)-2-methylsulfanylpyrimidine-5-carboxamide
CID 86065477
2-(2-aminopropylamino)-4-(4-carbamoyl-3-methoxyanilino)pyrimidine-5-carboxamide
CID 67002750
2-[(4,4-difluorocyclohexyl)amino]-4-[[(3S)-3-hydroxy-3-methylcyclohexyl]amino]pyrimidine-5-carboxamide
CID 71242345
2-(butylamino)-4-(cyclohexylamino)-N-(cyclohexylmethyl)pyrimidine-5-carboxamide
CID 144944262
2-(cyclopropylmethylamino)-4-[[(3R,4R)-3-hydroxy-4-methylcyclohexyl]amino]pyrimidine-5-carboxamide
CID 71242409
4-[(4-aminocyclohexyl)amino]-2-[(4-methoxycyclohexyl)amino]pyrimidine-5-carboxamide
CID 66576316
4-(3,3-dimethylbutan-2-ylamino)-2-[(4-ethoxycyclohexyl)amino]pyrimidine-5-carboxamide
CID 71237178
4-(cyclobutylamino)-2-[4-(diethylamino)anilino]pyrimidine-5-carboxamide
CID 58014750
4-[[(2R)-3,3-dimethylbutan-2-yl]amino]-2-[(4-ethoxycyclohexyl)amino]pyrimidine-5-carboxamide
CID 71237177

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide?
The IUPAC name of 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide (CID 70981953) is 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide.
What is the SMILES notation for 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide?
The canonical SMILES for 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide is CC(N)CNc1ncc(C(N)=O)c(NC2CCCCC2)n1.
What is the InChIKey of 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide?
The InChIKey is UAYBCKVPLZGCSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6O/c1-9(15)7-17-14-18-8-11(12(16)21)13(20-14)19-10-5-3-2-4-6-10/h8-10H,2-7,15H2,1H3,(H2,16,21)(H2,17,18,19,20).
What are the key properties of 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide?
2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide has a molecular weight of 292.39 g/mol, XLogP of 1.08, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide is sourced from PubChem (CID 70981953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).