[1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol

C12H15ClN6O — CID 62865200

IUPAC[1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol
SMILESOCC1(Nc2nc(Cl)nc(-n3ccnc3)n2)CCCC1
InChIInChI=1S/C12H15ClN6O/c13-9-15-10(18-12(7-20)3-1-2-4-12)17-11(16-9)19-6-5-14-8-19/h5-6,8,20H,1-4,7H2,(H,15,16,17,18)
InChIKeyATABMCHBMJDKQO-UHFFFAOYSA-N
MW294.75 g/mol
LogP1.43
Rot. Bonds4

About [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol

[1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol (PubChem CID 62865200) has the molecular formula C12H15ClN6O and a molecular weight of 294.75 g/mol. Its IUPAC name is [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol
PubChem CID62865200
Molecular FormulaC12H15ClN6O
Molecular Weight294.75 g/mol
Exact Mass294.10
IUPAC Name[1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol
SMILESOCC1(Nc2nc(Cl)nc(-n3ccnc3)n2)CCCC1
InChIInChI=1S/C12H15ClN6O/c13-9-15-10(18-12(7-20)3-1-2-4-12)17-11(16-9)19-6-5-14-8-19/h5-6,8,20H,1-4,7H2,(H,15,16,17,18)
InChIKeyATABMCHBMJDKQO-UHFFFAOYSA-N
XLogP1.43
TPSA88.75 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.75
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol with MolForge

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Related Compounds

[1-[[1-(Difluoromethyl)imidazol-2-yl]methylamino]cyclopentyl]methanol
CID 62517050
[1-[[1-(2,2,2-Trifluoroethyl)imidazol-2-yl]methylamino]cyclopentyl]methanol
CID 111916840
N-[1-(hydroxymethyl)cyclopentyl]imidazole-1-carboxamide
CID 59251184
2-[(4-Chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]butan-1-ol
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[1-[(1-Propylimidazol-2-yl)methylamino]cyclopentyl]methanol
CID 55153845
[1-[(5-Chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol
CID 62517226
[1-[(1-Methylimidazol-2-yl)amino]cyclopentyl]methanol
CID 62518706
[1-[(1-Ethylimidazol-2-yl)amino]cyclopentyl]methanol
CID 62518708
[1-(3-Imidazol-1-ylpropylamino)cyclopentyl]methanol
CID 62519336
[1-[2-(2-Methylimidazol-1-yl)ethylamino]cyclopentyl]methanol
CID 62519510
[1-[(1-Ethylimidazol-2-yl)amino]cyclohexyl]methanol
CID 62521177
[1-[(1-Methylimidazol-2-yl)amino]cyclohexyl]methanol
CID 62521339

Frequently Asked Questions

What is the IUPAC name of [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol?
The IUPAC name of [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol (CID 62865200) is [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol.
What is the SMILES notation for [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol?
The canonical SMILES for [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol is OCC1(Nc2nc(Cl)nc(-n3ccnc3)n2)CCCC1.
What is the InChIKey of [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol?
The InChIKey is ATABMCHBMJDKQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN6O/c13-9-15-10(18-12(7-20)3-1-2-4-12)17-11(16-9)19-6-5-14-8-19/h5-6,8,20H,1-4,7H2,(H,15,16,17,18).
What are the key properties of [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol?
[1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol has a molecular weight of 294.75 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-chloro-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]cyclopentyl]methanol is sourced from PubChem (CID 62865200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).