[1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol

C11H18ClN3O — CID 62517226

IUPAC[1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol
SMILESCn1c(Cl)cnc1CNC1(CO)CCCC1
InChIInChI=1S/C11H18ClN3O/c1-15-9(12)6-13-10(15)7-14-11(8-16)4-2-3-5-11/h6,14,16H,2-5,7-8H2,1H3
InChIKeyIRBCSFNUGJCTRH-UHFFFAOYSA-N
MW243.74 g/mol
LogP1.47
Rot. Bonds4

About [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol

[1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol (PubChem CID 62517226) has the molecular formula C11H18ClN3O and a molecular weight of 243.74 g/mol. Its IUPAC name is [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol
PubChem CID62517226
Molecular FormulaC11H18ClN3O
Molecular Weight243.74 g/mol
Exact Mass243.11
IUPAC Name[1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol
SMILESCn1c(Cl)cnc1CNC1(CO)CCCC1
InChIInChI=1S/C11H18ClN3O/c1-15-9(12)6-13-10(15)7-14-11(8-16)4-2-3-5-11/h6,14,16H,2-5,7-8H2,1H3
InChIKeyIRBCSFNUGJCTRH-UHFFFAOYSA-N
XLogP1.47
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.74
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol?
The IUPAC name of [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol (CID 62517226) is [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol.
What is the SMILES notation for [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol?
The canonical SMILES for [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol is Cn1c(Cl)cnc1CNC1(CO)CCCC1.
What is the InChIKey of [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol?
The InChIKey is IRBCSFNUGJCTRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClN3O/c1-15-9(12)6-13-10(15)7-14-11(8-16)4-2-3-5-11/h6,14,16H,2-5,7-8H2,1H3.
What are the key properties of [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol?
[1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol has a molecular weight of 243.74 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5-chloro-1-methylimidazol-2-yl)methylamino]cyclopentyl]methanol is sourced from PubChem (CID 62517226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).