5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride

C14H27ClN4O — CID 25178088

IUPAC5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride
SMILESCCCCCCNC(=O)CCCCc1cnc(N)[nH]1.Cl
InChIInChI=1S/C14H26N4O.ClH/c1-2-3-4-7-10-16-13(19)9-6-5-8-12-11-17-14(15)18-12;/h11H,2-10H2,1H3,(H,16,19)(H3,15,17,18);1H
InChIKeyVLTSDANPFAPJKB-UHFFFAOYSA-N
MW302.85 g/mol
LogP2.82
Rot. Bonds10

About 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride

5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride (PubChem CID 25178088) has the molecular formula C14H27ClN4O and a molecular weight of 302.85 g/mol. Its IUPAC name is 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride.

Molecular Properties

Compound Name5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride
PubChem CID25178088
Molecular FormulaC14H27ClN4O
Molecular Weight302.85 g/mol
Exact Mass302.19
IUPAC Name5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride
SMILESCCCCCCNC(=O)CCCCc1cnc(N)[nH]1.Cl
InChIInChI=1S/C14H26N4O.ClH/c1-2-3-4-7-10-16-13(19)9-6-5-8-12-11-17-14(15)18-12;/h11H,2-10H2,1H3,(H,16,19)(H3,15,17,18);1H
InChIKeyVLTSDANPFAPJKB-UHFFFAOYSA-N
XLogP2.82
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.85
LogP ≤ 52.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride 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

5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide
CID 25178089
5-heptadecyl-1H-imidazol-2-amine
CID 25178085
3-(2-amino-1H-imidazol-5-yl)propylurea;hydrochloride
CID 131859934
N-[4-(2-amino-1H-imidazol-5-yl)tridecyl]butanamide
CID 175568341
N-dodecylhexanamide
CID 3362981
N,N'-dihexadecyldecanediamide
CID 17080069
N-[7-(dodecanoylamino)heptyl]dodecanamide
CID 4580774
N-[6-(pentadecanoylamino)hexyl]pentadecanamide
CID 102117556
N-[8-(dodecanoylamino)octyl]dodecanamide
CID 3273664
N-tetradecyloctanamide
CID 151737522
N-[6-(tricosanoylamino)hexyl]tricosanamide
CID 102117558
N-nonyltridecanamide
CID 154228217

Frequently Asked Questions

What is the IUPAC name of 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride?
The IUPAC name of 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride (CID 25178088) is 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride.
What is the SMILES notation for 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride?
The canonical SMILES for 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride is CCCCCCNC(=O)CCCCc1cnc(N)[nH]1.Cl.
What is the InChIKey of 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride?
The InChIKey is VLTSDANPFAPJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O.ClH/c1-2-3-4-7-10-16-13(19)9-6-5-8-12-11-17-14(15)18-12;/h11H,2-10H2,1H3,(H,16,19)(H3,15,17,18);1H.
What are the key properties of 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride?
5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride has a molecular weight of 302.85 g/mol, XLogP of 2.82, 10 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-amino-1H-imidazol-5-yl)-N-hexylpentanamide;hydrochloride is sourced from PubChem (CID 25178088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).