2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol

C10H13N3O2 — CID 106108763

IUPAC2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol
SMILESCOC(CN)c1nc2ccc(O)cc2[nH]1
InChIInChI=1S/C10H13N3O2/c1-15-9(5-11)10-12-7-3-2-6(14)4-8(7)13-10/h2-4,9,14H,5,11H2,1H3,(H,12,13)
InChIKeyLRHIYEAQBDWRFH-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.91
Rot. Bonds3

About 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol

2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol (PubChem CID 106108763) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol.

Molecular Properties

Compound Name2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol
PubChem CID106108763
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol
SMILESCOC(CN)c1nc2ccc(O)cc2[nH]1
InChIInChI=1S/C10H13N3O2/c1-15-9(5-11)10-12-7-3-2-6(14)4-8(7)13-10/h2-4,9,14H,5,11H2,1H3,(H,12,13)
InChIKeyLRHIYEAQBDWRFH-UHFFFAOYSA-N
XLogP0.91
TPSA84.16 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-aminopropan-2-yl)-3H-benzimidazol-5-ol
CID 81432291
2-[(1S)-1-aminoethyl]-3H-benzimidazol-5-ol
CID 69314900
2-pentan-2-yl-3H-benzimidazol-5-ol
CID 81431667
2-[amino(cyclopropyl)methyl]-3H-benzimidazol-5-ol
CID 81432300
2-(1-morpholin-4-ylethyl)-3H-benzimidazol-5-ol
CID 82336117
2-(6-methoxy-1H-benzimidazol-2-yl)butan-1-amine
CID 65220884
2-(3-methoxy-2-methylpropyl)-3H-benzimidazol-5-ol
CID 81431992
2-(1-ethylcyclopentyl)-3H-benzimidazol-5-ol
CID 81432326
2-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]-3H-benzimidazol-5-ol
CID 82336102
2-(6-hydroxy-1H-benzimidazol-2-yl)-1,3-bis(3-methylphenyl)propane-1,3-dione
CID 90827603
O-[(2-propan-2-yl-3H-benzimidazol-5-yl)methyl]hydroxylamine
CID 117293706
2-(6-chloro-1H-benzimidazol-2-yl)butan-1-amine
CID 65221447

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol?
The IUPAC name of 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol (CID 106108763) is 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol.
What is the SMILES notation for 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol?
The canonical SMILES for 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol is COC(CN)c1nc2ccc(O)cc2[nH]1.
What is the InChIKey of 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol?
The InChIKey is LRHIYEAQBDWRFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-15-9(5-11)10-12-7-3-2-6(14)4-8(7)13-10/h2-4,9,14H,5,11H2,1H3,(H,12,13).
What are the key properties of 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol?
2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol has a molecular weight of 207.23 g/mol, XLogP of 0.91, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1-methoxyethyl)-3H-benzimidazol-5-ol is sourced from PubChem (CID 106108763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).