4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine

C11H16ClN3 — CID 163247764

IUPAC4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine
SMILESCC1(c2cc(Cl)nc(N)n2)CCCCC1
InChIInChI=1S/C11H16ClN3/c1-11(5-3-2-4-6-11)8-7-9(12)15-10(13)14-8/h7H,2-6H2,1H3,(H2,13,14,15)
InChIKeyFHMWZYWBCDUAMR-UHFFFAOYSA-N
MW225.72 g/mol
LogP2.93
Rot. Bonds1

About 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine

4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine (PubChem CID 163247764) has the molecular formula C11H16ClN3 and a molecular weight of 225.72 g/mol. Its IUPAC name is 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine
PubChem CID163247764
Molecular FormulaC11H16ClN3
Molecular Weight225.72 g/mol
Exact Mass225.10
IUPAC Name4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine
SMILESCC1(c2cc(Cl)nc(N)n2)CCCCC1
InChIInChI=1S/C11H16ClN3/c1-11(5-3-2-4-6-11)8-7-9(12)15-10(13)14-8/h7H,2-6H2,1H3,(H2,13,14,15)
InChIKeyFHMWZYWBCDUAMR-UHFFFAOYSA-N
XLogP2.93
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.72
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-4-N-[(1-methylcyclopentyl)methyl]pyrimidine-2,4-diamine
CID 78952257
6-chloro-4-N-(4,4-dimethylcyclohexyl)pyrimidine-2,4-diamine
CID 79033810
1-(2,6-dichloropyrimidin-4-yl)cyclodecane-1-carbonitrile
CID 134170538
4-[4-chloro-6-(1-methylcyclopropyl)pyrimidin-2-yl]morpholine
CID 145100368
4-(3-chlorophenyl)-2-(1-methylcyclopentyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine
CID 154465607
2,4-dichloro-6-(1-methylcyclohexyl)-1,3,5-triazine
CID 121389488
5-(1-methylcyclohexyl)-1,2,4-thiadiazol-3-amine
CID 106829181
4-chloro-2-fluoro-1-(1-methylcyclohexyl)benzene
CID 175792533
6-chloro-2-N-(1-methylcyclohexyl)pyridine-2,3-diamine
CID 115474028
4-(4-chlorophenyl)-3-(1-methylcyclohexyl)-1,2-oxazol-5-amine
CID 106827670
6-chloro-4-N-[(1-phenylcyclopentyl)methyl]pyrimidine-2,4-diamine
CID 55570136
5,6-dichloro-2-(1-methylcyclopentyl)-1H-imidazo[4,5-b]pyridine
CID 113360917

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine?
The IUPAC name of 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine (CID 163247764) is 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine.
What is the SMILES notation for 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine?
The canonical SMILES for 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine is CC1(c2cc(Cl)nc(N)n2)CCCCC1.
What is the InChIKey of 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine?
The InChIKey is FHMWZYWBCDUAMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3/c1-11(5-3-2-4-6-11)8-7-9(12)15-10(13)14-8/h7H,2-6H2,1H3,(H2,13,14,15).
What are the key properties of 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine?
4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine has a molecular weight of 225.72 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(1-methylcyclohexyl)pyrimidin-2-amine is sourced from PubChem (CID 163247764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).