5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol

C10H19N3O — CID 81422830

IUPAC5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol
SMILESCCn1cncc1C(CN)CC(C)O
InChIInChI=1S/C10H19N3O/c1-3-13-7-12-6-10(13)9(5-11)4-8(2)14/h6-9,14H,3-5,11H2,1-2H3
InChIKeyKIXIYTLKJJORHN-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.72
Rot. Bonds5

About 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol

5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol (PubChem CID 81422830) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol.

Molecular Properties

Compound Name5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol
PubChem CID81422830
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol
SMILESCCn1cncc1C(CN)CC(C)O
InChIInChI=1S/C10H19N3O/c1-3-13-7-12-6-10(13)9(5-11)4-8(2)14/h6-9,14H,3-5,11H2,1-2H3
InChIKeyKIXIYTLKJJORHN-UHFFFAOYSA-N
XLogP0.72
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-1-(3-ethylimidazol-4-yl)-3-methylbutan-1-ol
CID 115347562
2-amino-1-(3-ethylimidazol-4-yl)butan-1-ol
CID 66133374
2-(3-ethylimidazol-4-yl)propanoic acid
CID 83873746
1-(3-ethylimidazol-4-yl)prop-2-en-1-ol
CID 66132482
1-(3-ethylimidazol-4-yl)-2-methoxyethanol
CID 79566598
1-(3-ethylimidazol-4-yl)-3-methylbut-2-en-1-ol
CID 79190582
ethyl 2-[(3-ethylimidazol-4-yl)-hydroxymethyl]-3-methylbutanoate
CID 66134341
3-amino-3-(3-ethylimidazol-4-yl)propanoic acid
CID 66132745
N-ethyl-1-(3-ethylimidazol-4-yl)-N-(1-methoxypropan-2-yl)ethane-1,2-diamine
CID 66133479
1-(3-ethylimidazol-4-yl)-2-(4-ethylphenyl)ethanol
CID 66134129
2-(4,4-dimethylpiperidin-1-yl)-2-(3-ethylimidazol-4-yl)ethanamine
CID 66133686
N-cyclopropyl-1-(3-ethylimidazol-4-yl)-N-methylethane-1,2-diamine
CID 66134488

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol?
The IUPAC name of 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol (CID 81422830) is 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol.
What is the SMILES notation for 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol?
The canonical SMILES for 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol is CCn1cncc1C(CN)CC(C)O.
What is the InChIKey of 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol?
The InChIKey is KIXIYTLKJJORHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-3-13-7-12-6-10(13)9(5-11)4-8(2)14/h6-9,14H,3-5,11H2,1-2H3.
What are the key properties of 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol?
5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol has a molecular weight of 197.28 g/mol, XLogP of 0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-(3-ethylimidazol-4-yl)pentan-2-ol is sourced from PubChem (CID 81422830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).