2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine

C10H13Cl2N3 — CID 130569686

IUPAC2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine
SMILESCN(c1cc(Cl)nc(Cl)n1)C1CCCC1
InChIInChI=1S/C10H13Cl2N3/c1-15(7-4-2-3-5-7)9-6-8(11)13-10(12)14-9/h6-7H,2-5H2,1H3
InChIKeyURYWQIIEBDCEPU-UHFFFAOYSA-N
MW246.14 g/mol
LogP3.16
Rot. Bonds2

About 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine

2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine (PubChem CID 130569686) has the molecular formula C10H13Cl2N3 and a molecular weight of 246.14 g/mol. Its IUPAC name is 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine
PubChem CID130569686
Molecular FormulaC10H13Cl2N3
Molecular Weight246.14 g/mol
Exact Mass245.05
IUPAC Name2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine
SMILESCN(c1cc(Cl)nc(Cl)n1)C1CCCC1
InChIInChI=1S/C10H13Cl2N3/c1-15(7-4-2-3-5-7)9-6-8(11)13-10(12)14-9/h6-7H,2-5H2,1H3
InChIKeyURYWQIIEBDCEPU-UHFFFAOYSA-N
XLogP3.16
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.14
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-cyclobutyl-N-methyl-6-(trifluoromethyl)pyrimidin-4-amine
CID 114562925
2-chloro-N-cyclohexyl-N-methyl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 166460267
2-chloro-6-[cyclohexyl(methyl)amino]pyridine-4-carbonitrile
CID 83073662
6-chloro-N-cyclohexyl-2-(ethoxymethyl)-N-methylpyrimidin-4-amine
CID 113400782
2-chloro-N-methyl-N-(3-methylcyclohexyl)-6-(trifluoromethyl)pyrimidin-4-amine
CID 114562345
2-chloro-N-(1-ethylpiperidin-4-yl)-N,6-dimethylpyrimidin-4-amine
CID 62481992
6-chloro-N,2-dimethyl-N-(2-methylcyclohexyl)pyrimidin-4-amine
CID 62483372
4-N-cycloheptyl-4-N-methylpyrimidine-2,4,6-triamine
CID 80788881
6-chloro-N,2-dimethyl-N-[(3S)-thiolan-3-yl]pyrimidin-4-amine
CID 129367917
N-tert-butyl-2,6-dichloro-N-methylpyrimidin-4-amine
CID 90303688
2-chloro-N,6-dimethyl-N-[(3S)-pyrrolidin-3-yl]pyrimidin-4-amine
CID 71641175
4-N-cyclopentyl-4-N,6-N,2-trimethylpyrimidine-4,6-diamine
CID 80774637

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine?
The IUPAC name of 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine (CID 130569686) is 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine.
What is the SMILES notation for 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine?
The canonical SMILES for 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine is CN(c1cc(Cl)nc(Cl)n1)C1CCCC1.
What is the InChIKey of 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine?
The InChIKey is URYWQIIEBDCEPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2N3/c1-15(7-4-2-3-5-7)9-6-8(11)13-10(12)14-9/h6-7H,2-5H2,1H3.
What are the key properties of 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine?
2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine has a molecular weight of 246.14 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-cyclopentyl-N-methylpyrimidin-4-amine is sourced from PubChem (CID 130569686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).