[5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol

C10H14N4O — CID 83024491

IUPAC[5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol
SMILESCN(C)n1c(CO)nc2cc(N)ccc21
InChIInChI=1S/C10H14N4O/c1-13(2)14-9-4-3-7(11)5-8(9)12-10(14)6-15/h3-5,15H,6,11H2,1-2H3
InChIKeyNMTAGZNTCRMHIU-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.31
Rot. Bonds2

About [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol

[5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol (PubChem CID 83024491) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol.

Molecular Properties

Compound Name[5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol
PubChem CID83024491
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name[5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol
SMILESCN(C)n1c(CO)nc2cc(N)ccc21
InChIInChI=1S/C10H14N4O/c1-13(2)14-9-4-3-7(11)5-8(9)12-10(14)6-15/h3-5,15H,6,11H2,1-2H3
InChIKeyNMTAGZNTCRMHIU-UHFFFAOYSA-N
XLogP0.31
TPSA67.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

[5-amino-1-(2-methylpropyl)benzimidazol-2-yl]methanol
CID 62591105
(5-amino-1-pentan-2-ylbenzimidazol-2-yl)methanol
CID 62594152
[5-amino-1-(4-methylpiperazin-1-yl)benzimidazol-2-yl]methanol
CID 83024690
[5-amino-1-(4-bromo-2,6-dimethylphenyl)benzimidazol-2-yl]methanol
CID 65499669
[5-amino-1-(4-iodophenyl)benzimidazol-2-yl]methanol
CID 62595630
[5-amino-1-(3-ethoxypropyl)benzimidazol-2-yl]methanol
CID 62589251
2-[5-amino-2-(hydroxymethyl)benzimidazol-1-yl]-3-methoxypropan-1-ol
CID 114155636
[5-amino-1-(3,4-dichlorophenyl)benzimidazol-2-yl]methanol
CID 62594707
2-[5-amino-2-(hydroxymethyl)benzimidazol-1-yl]ethanesulfonamide
CID 55091658
[5-amino-1-(1-phenylpropan-2-yl)benzimidazol-2-yl]methanol
CID 63011474
3-[5-amino-2-(hydroxymethyl)benzimidazol-1-yl]-4-methoxybutan-1-ol
CID 106162666
[5-amino-1-(2,5-difluoro-4-methylphenyl)benzimidazol-2-yl]methanol
CID 103587462

Frequently Asked Questions

What is the IUPAC name of [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol?
The IUPAC name of [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol (CID 83024491) is [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol.
What is the SMILES notation for [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol?
The canonical SMILES for [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol is CN(C)n1c(CO)nc2cc(N)ccc21.
What is the InChIKey of [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol?
The InChIKey is NMTAGZNTCRMHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-13(2)14-9-4-3-7(11)5-8(9)12-10(14)6-15/h3-5,15H,6,11H2,1-2H3.
What are the key properties of [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol?
[5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol has a molecular weight of 206.25 g/mol, XLogP of 0.31, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-amino-1-(dimethylamino)benzimidazol-2-yl]methanol is sourced from PubChem (CID 83024491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).