4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine

C10H15ClN4 — CID 107186454

IUPAC4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine
SMILESCC1(C)CCCC1c1nc(N)nc(Cl)n1
InChIInChI=1S/C10H15ClN4/c1-10(2)5-3-4-6(10)7-13-8(11)15-9(12)14-7/h6H,3-5H2,1-2H3,(H2,12,13,14,15)
InChIKeyBGRMRWPVPIFZGD-UHFFFAOYSA-N
MW226.71 g/mol
LogP2.40
Rot. Bonds1

About 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine

4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine (PubChem CID 107186454) has the molecular formula C10H15ClN4 and a molecular weight of 226.71 g/mol. Its IUPAC name is 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine
PubChem CID107186454
Molecular FormulaC10H15ClN4
Molecular Weight226.71 g/mol
Exact Mass226.10
IUPAC Name4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine
SMILESCC1(C)CCCC1c1nc(N)nc(Cl)n1
InChIInChI=1S/C10H15ClN4/c1-10(2)5-3-4-6(10)7-13-8(11)15-9(12)14-7/h6H,3-5H2,1-2H3,(H2,12,13,14,15)
InChIKeyBGRMRWPVPIFZGD-UHFFFAOYSA-N
XLogP2.40
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2,2-dimethylcyclopentyl)-1,3,5-triazine-2,4-diamine
CID 107176876
4-chloro-6-cyclooctyl-1,3,5-triazin-2-amine
CID 83241557
5-(2,2-dimethylcyclopentyl)-1,2,4-oxadiazol-3-amine
CID 107182962
4-chloro-6-piperidin-2-yl-1,3,5-triazin-2-amine
CID 174788663
2-chloro-5-(2,2-dimethylcyclopentyl)-1,3,4-thiadiazole
CID 107183813
4-chloro-6-[2-(trifluoromethyl)cyclohexyl]-1,3,5-triazin-2-amine
CID 113434047
5-(2,2-dimethylcyclopentyl)-1,2,4-triazole-3,4-diamine
CID 107176865
4-chloro-6-(1-phenylpyrrolidin-2-yl)-1,3,5-triazin-2-amine
CID 138974253
3-(2,2-dimethylcyclopentyl)-1,2-oxazol-5-amine
CID 107179723
3-cyclopropyl-5-(2,2-dimethylcyclopentyl)-1H-1,2,4-triazole
CID 107180038
4,6-dichloro-N-(2,2-dimethylcyclohexyl)-1,3,5-triazin-2-amine
CID 79873127
4-(2,4-dichlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine
CID 107185949

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine (CID 107186454) is 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine is CC1(C)CCCC1c1nc(N)nc(Cl)n1.
What is the InChIKey of 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine?
The InChIKey is BGRMRWPVPIFZGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4/c1-10(2)5-3-4-6(10)7-13-8(11)15-9(12)14-7/h6H,3-5H2,1-2H3,(H2,12,13,14,15).
What are the key properties of 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine?
4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine has a molecular weight of 226.71 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(2,2-dimethylcyclopentyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 107186454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).