2-amino-1-(3-propylimidazol-4-yl)butan-1-ol

C10H19N3O — CID 66129932

IUPAC2-amino-1-(3-propylimidazol-4-yl)butan-1-ol
SMILESCCCn1cncc1C(O)C(N)CC
InChIInChI=1S/C10H19N3O/c1-3-5-13-7-12-6-9(13)10(14)8(11)4-2/h6-8,10,14H,3-5,11H2,1-2H3
InChIKeyYOPXHXIKZKZVEE-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.06
Rot. Bonds5

About 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol

2-amino-1-(3-propylimidazol-4-yl)butan-1-ol (PubChem CID 66129932) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol.

Molecular Properties

Compound Name2-amino-1-(3-propylimidazol-4-yl)butan-1-ol
PubChem CID66129932
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-amino-1-(3-propylimidazol-4-yl)butan-1-ol
SMILESCCCn1cncc1C(O)C(N)CC
InChIInChI=1S/C10H19N3O/c1-3-5-13-7-12-6-9(13)10(14)8(11)4-2/h6-8,10,14H,3-5,11H2,1-2H3
InChIKeyYOPXHXIKZKZVEE-UHFFFAOYSA-N
XLogP1.06
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 ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-1-(3-propylimidazol-4-yl)butan-1-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)butan-1-ol
CID 66133374
2-amino-1-(3-methylimidazol-4-yl)butan-1-ol
CID 66116586
methyl 4-amino-3-(3-propylimidazol-4-yl)hexanoate
CID 66132058
2-amino-2-(3-propylimidazol-4-yl)acetonitrile
CID 66130812
2-amino-1-(3-ethylimidazol-4-yl)-3-methylbutan-1-ol
CID 115347562
(2S)-2-amino-3-(3-propylimidazol-4-yl)propanoic acid
CID 54225588
1-(3-butylimidazol-4-yl)ethanamine
CID 114702792
2-cyclopentyl-1-(3-propylimidazol-4-yl)ethanol
CID 66129443
2,2-difluoro-3-hydroxy-3-(3-propylimidazol-4-yl)propanoic acid
CID 66131850
(3,5-difluorophenyl)-(3-propylimidazol-4-yl)methanol
CID 66131636
N-methyl-1-(3-propylimidazol-4-yl)ethane-1,2-diamine
CID 66130411
N,N-diethyl-1-(3-propylimidazol-4-yl)ethane-1,2-diamine
CID 66131396

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol?
The IUPAC name of 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol (CID 66129932) is 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol.
What is the SMILES notation for 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol?
The canonical SMILES for 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol is CCCn1cncc1C(O)C(N)CC.
What is the InChIKey of 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol?
The InChIKey is YOPXHXIKZKZVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-3-5-13-7-12-6-9(13)10(14)8(11)4-2/h6-8,10,14H,3-5,11H2,1-2H3.
What are the key properties of 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol?
2-amino-1-(3-propylimidazol-4-yl)butan-1-ol has a molecular weight of 197.28 g/mol, XLogP of 1.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(3-propylimidazol-4-yl)butan-1-ol is sourced from PubChem (CID 66129932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).