N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide

C11H19N3O2 — CID 107299783

IUPACN-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide
SMILESCC(O)CCCNC(=O)CCn1ccnc1
InChIInChI=1S/C11H19N3O2/c1-10(15)3-2-5-13-11(16)4-7-14-8-6-12-9-14/h6,8-10,15H,2-5,7H2,1H3,(H,13,16)
InChIKeyQCJLKHCAHSGMOU-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.55
Rot. Bonds7

About N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide

N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide (PubChem CID 107299783) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide
PubChem CID107299783
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide
SMILESCC(O)CCCNC(=O)CCn1ccnc1
InChIInChI=1S/C11H19N3O2/c1-10(15)3-2-5-13-11(16)4-7-14-8-6-12-9-14/h6,8-10,15H,2-5,7H2,1H3,(H,13,16)
InChIKeyQCJLKHCAHSGMOU-UHFFFAOYSA-N
XLogP0.55
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide 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

(3S)-5-(3-imidazol-1-ylpropanoylamino)-3-methylpentanamide
CID 173104435
N-(2-aminopropyl)-3-imidazol-1-ylpropanamide
CID 63733352
N-(5-imidazol-1-ylpentyl)-3-methylbutanamide
CID 110442138
N-(4-hydroxy-2-methylpentyl)-4-imidazol-1-ylbutanamide
CID 111447010
3-(ethylamino)-N-(3-imidazol-1-ylpropyl)propanamide
CID 62833387
N-(3-imidazol-1-ylpropyl)tridecanamide
CID 142486027
4-(3-imidazol-1-ylpropylamino)-4-oxobutanoate
CID 7009162
N-(4-hydroxybutan-2-yl)-3-imidazol-1-ylpropanamide
CID 115283469
propan-2-yl N-(4-imidazol-1-ylbutyl)carbamate
CID 116655262
2-bromo-N-(4-imidazol-1-ylbutyl)propanamide
CID 107905070
6-(2-imidazol-1-ylethylamino)-6-oxohexanoic acid
CID 61325108
7-amino-N-(3-imidazol-1-ylpropyl)heptanamide
CID 28994147

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide?
The IUPAC name of N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide (CID 107299783) is N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide.
What is the SMILES notation for N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide?
The canonical SMILES for N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide is CC(O)CCCNC(=O)CCn1ccnc1.
What is the InChIKey of N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide?
The InChIKey is QCJLKHCAHSGMOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-10(15)3-2-5-13-11(16)4-7-14-8-6-12-9-14/h6,8-10,15H,2-5,7H2,1H3,(H,13,16).
What are the key properties of N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide?
N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide has a molecular weight of 225.29 g/mol, XLogP of 0.55, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxypentyl)-3-imidazol-1-ylpropanamide is sourced from PubChem (CID 107299783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).