4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine

C12H20N4 — CID 62319423

IUPAC4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine
SMILESCc1cc(C)nc(NC2CCC(N)CC2)n1
InChIInChI=1S/C12H20N4/c1-8-7-9(2)15-12(14-8)16-11-5-3-10(13)4-6-11/h7,10-11H,3-6,13H2,1-2H3,(H,14,15,16)
InChIKeyRAHZCZQKRHNBRM-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.78
Rot. Bonds2

About 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine

4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine (PubChem CID 62319423) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine.

Molecular Properties

Compound Name4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine
PubChem CID62319423
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine
SMILESCc1cc(C)nc(NC2CCC(N)CC2)n1
InChIInChI=1S/C12H20N4/c1-8-7-9(2)15-12(14-8)16-11-5-3-10(13)4-6-11/h7,10-11H,3-6,13H2,1-2H3,(H,14,15,16)
InChIKeyRAHZCZQKRHNBRM-UHFFFAOYSA-N
XLogP1.78
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1,1-dioxothian-4-yl)-4,6-dimethylpyrimidin-2-amine
CID 43615421
N-(3,4-dimethylcyclohexyl)-4,6-dimethylpyrimidin-2-amine
CID 64741526
2-(cyclopropylamino)-6-methylpyrimidine-4-carbothioamide
CID 107546159
4-N-(5-methylpyrimidin-2-yl)cyclohexane-1,4-diamine
CID 63208372
methyl 4-[(4,6-dimethylpyrimidin-2-yl)amino]cyclohexane-1-carboxylate
CID 112689982
2-[(4-aminocyclohexyl)amino]-6-methylpyridine-4-carbonitrile
CID 114768292
6-methyl-2-N-piperidin-4-ylpyrimidine-2,4-diamine
CID 115025325
N-cyclopropyl-4-ethoxy-6-methylpyrimidin-2-amine
CID 94830490
1-N-(4-methoxy-6-methylpyrimidin-2-yl)cyclobutane-1,3-diamine
CID 112634754
4,6-dimethyl-N-(3-methylcyclohexyl)pyrimidin-2-amine
CID 43428255
4-N-pyrimidin-2-ylcyclohexane-1,4-diamine;hydrochloride
CID 71643877
4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80769558

Frequently Asked Questions

What is the IUPAC name of 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine?
The IUPAC name of 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine (CID 62319423) is 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine.
What is the SMILES notation for 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine?
The canonical SMILES for 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine is Cc1cc(C)nc(NC2CCC(N)CC2)n1.
What is the InChIKey of 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine?
The InChIKey is RAHZCZQKRHNBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-8-7-9(2)15-12(14-8)16-11-5-3-10(13)4-6-11/h7,10-11H,3-6,13H2,1-2H3,(H,14,15,16).
What are the key properties of 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine?
4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine has a molecular weight of 220.32 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(4,6-dimethylpyrimidin-2-yl)cyclohexane-1,4-diamine is sourced from PubChem (CID 62319423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).