4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine

C13H24N4 — CID 152780334

IUPAC4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine
SMILESCNC1(C)C=C(NC2CCC(C)CC2)NC=N1
InChIInChI=1S/C13H24N4/c1-10-4-6-11(7-5-10)17-12-8-13(2,14-3)16-9-15-12/h8-11,14,17H,4-7H2,1-3H3,(H,15,16)
InChIKeyWIZPXXMJLXWMBX-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.56
Rot. Bonds3

About 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine

4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine (PubChem CID 152780334) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine
PubChem CID152780334
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine
SMILESCNC1(C)C=C(NC2CCC(C)CC2)NC=N1
InChIInChI=1S/C13H24N4/c1-10-4-6-11(7-5-10)17-12-8-13(2,14-3)16-9-15-12/h8-11,14,17H,4-7H2,1-3H3,(H,15,16)
InChIKeyWIZPXXMJLXWMBX-UHFFFAOYSA-N
XLogP1.56
TPSA48.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-cyclohexyl-1H-pyrimidine-4,6-diamine
CID 144213044
4-[2-(Dimethylamino)ethyl]-2-(3-methylcyclohexyl)imino-1,3-dihydropyrimidin-4-amine
CID 153906997
4-[2-(Dimethylamino)ethyl]-2-(4-methylcyclohexyl)imino-1,3-dihydropyrimidin-4-amine
CID 153906998
4-cyclohexyl-6-N-[2-(dimethylamino)ethyl]-1H-pyrimidine-2,4,6-triamine
CID 153920639
6-[(2-methylcyclohexyl)amino]-1H-pyrimidine-4-thione
CID 82457090

Frequently Asked Questions

What is the IUPAC name of 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine?
The IUPAC name of 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine (CID 152780334) is 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine.
What is the SMILES notation for 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine?
The canonical SMILES for 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine is CNC1(C)C=C(NC2CCC(C)CC2)NC=N1.
What is the InChIKey of 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine?
The InChIKey is WIZPXXMJLXWMBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-10-4-6-11(7-5-10)17-12-8-13(2,14-3)16-9-15-12/h8-11,14,17H,4-7H2,1-3H3,(H,15,16).
What are the key properties of 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine?
4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine has a molecular weight of 236.36 g/mol, XLogP of 1.56, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-dimethyl-6-N-(4-methylcyclohexyl)-1H-pyrimidine-4,6-diamine is sourced from PubChem (CID 152780334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).