[6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol

C10H13N3O — CID 104713063

IUPAC[6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol
SMILESCn1c(CO)nc2ccc(CN)cc21
InChIInChI=1S/C10H13N3O/c1-13-9-4-7(5-11)2-3-8(9)12-10(13)6-14/h2-4,14H,5-6,11H2,1H3
InChIKeyIWFQQGLCLKBFDQ-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.52
Rot. Bonds2

About [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol

[6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol (PubChem CID 104713063) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol.

Molecular Properties

Compound Name[6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol
PubChem CID104713063
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name[6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol
SMILESCn1c(CO)nc2ccc(CN)cc21
InChIInChI=1S/C10H13N3O/c1-13-9-4-7(5-11)2-3-8(9)12-10(13)6-14/h2-4,14H,5-6,11H2,1H3
InChIKeyIWFQQGLCLKBFDQ-UHFFFAOYSA-N
XLogP0.52
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(3,3-dimethylbutyl)-3-methylbenzimidazol-5-yl]methanamine
CID 114212936
[2-[(4-chlorophenyl)methyl]-3-methylbenzimidazol-5-yl]methanamine
CID 104713141
6-(aminomethyl)-1-methylbenzimidazol-2-amine
CID 84767207
[3-methyl-2-(2-pyridin-4-ylethyl)benzimidazol-5-yl]methanamine
CID 104712932
[2-(cyclobutylmethyl)-3-methylbenzimidazol-5-yl]methanamine
CID 103167106
[2-[(3-ethoxycyclobutyl)methyl]-3-methylbenzimidazol-5-yl]methanamine
CID 103167107
[3-methyl-2-(2,2,2-trifluoroethoxymethyl)benzimidazol-5-yl]methanamine
CID 103213116
[2-[(3-bromophenyl)methyl]-3-methylbenzimidazol-5-yl]methanamine
CID 104713039
[2-(3,4-difluorophenyl)-3-methylbenzimidazol-5-yl]methanamine
CID 104713201
(6-fluoro-1-methylbenzimidazol-2-yl)methanamine
CID 62377229
[3-methyl-2-(6-methyl-2-pyridinyl)benzimidazol-5-yl]methanamine
CID 104712925
[2-[(dimethylamino)methyl]-1-methylbenzimidazol-5-yl]methanamine
CID 65037741

Frequently Asked Questions

What is the IUPAC name of [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol?
The IUPAC name of [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol (CID 104713063) is [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol.
What is the SMILES notation for [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol?
The canonical SMILES for [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol is Cn1c(CO)nc2ccc(CN)cc21.
What is the InChIKey of [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol?
The InChIKey is IWFQQGLCLKBFDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-13-9-4-7(5-11)2-3-8(9)12-10(13)6-14/h2-4,14H,5-6,11H2,1H3.
What are the key properties of [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol?
[6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol has a molecular weight of 191.23 g/mol, XLogP of 0.52, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(aminomethyl)-1-methylbenzimidazol-2-yl]methanol is sourced from PubChem (CID 104713063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).