1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide

C24H29N3O3 — CID 22628514

IUPAC1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide
SMILESNC(=O)c1cn(CC(O)CCCc2ccccc2OCCCc2ccccc2)cn1
InChIInChI=1S/C24H29N3O3/c25-24(29)22-17-27(18-26-22)16-21(28)13-6-12-20-11-4-5-14-23(20)30-15-7-10-19-8-2-1-3-9-19/h1-5,8-9,11,14,17-18,21,28H,6-7,10,12-13,15-16H2,(H2,25,29)
InChIKeyOMBMUISLHRVUOP-UHFFFAOYSA-N
MW407.51 g/mol
LogP3.38
Rot. Bonds12

About 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide

1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide (PubChem CID 22628514) has the molecular formula C24H29N3O3 and a molecular weight of 407.51 g/mol. Its IUPAC name is 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide.

Molecular Properties

Compound Name1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide
PubChem CID22628514
Molecular FormulaC24H29N3O3
Molecular Weight407.51 g/mol
Exact Mass407.22
IUPAC Name1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide
SMILESNC(=O)c1cn(CC(O)CCCc2ccccc2OCCCc2ccccc2)cn1
InChIInChI=1S/C24H29N3O3/c25-24(29)22-17-27(18-26-22)16-21(28)13-6-12-20-11-4-5-14-23(20)30-15-7-10-19-8-2-1-3-9-19/h1-5,8-9,11,14,17-18,21,28H,6-7,10,12-13,15-16H2,(H2,25,29)
InChIKeyOMBMUISLHRVUOP-UHFFFAOYSA-N
XLogP3.38
TPSA90.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.51
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide 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

1-[2-hydroxy-5-[2-[(4-methylsulfanylphenyl)methoxy]phenyl]pentyl]imidazole-4-carboxamide
CID 22391673
1-[5-[2-[[3,5-bis(trifluoromethyl)phenyl]methoxy]phenyl]-2-hydroxypentyl]imidazole-4-carboxamide
CID 22391699
1-[2-hydroxy-5-[2-[(4-thiophen-2-ylphenyl)methoxy]phenyl]pentyl]imidazole-4-carboxamide
CID 22391690
1-[2-hydroxy-5-[2-[[4-(thiadiazol-4-yl)phenyl]methoxy]phenyl]pentyl]imidazole-4-carboxamide
CID 22391727
1-(2-hydroxy-5-naphthalen-2-ylpentyl)imidazole-4-carboxamide
CID 22628538
1-[1-[2-[3-(4-chlorophenyl)propoxy]phenyl]-4-hydroxypentan-3-yl]imidazole-4-carboxamide
CID 10275108
1-(6-phenyl-2-phenylmethoxyhexyl)imidazole-4-carboxamide
CID 22628453
1-[5-[3-(4-fluorophenyl)phenoxy]-2-hydroxypentyl]imidazole-4-carboxamide
CID 22055006
1-[5-[3-(3,5-dichlorophenyl)phenoxy]-2-hydroxypentyl]imidazole-4-carboxamide
CID 22054979
N-(diaminomethylidene)-1-(1-hydroxy-4-phenylbutyl)imidazole-4-carboxamide
CID 22628535
1-(2-methoxyphenyl)-5-phenylpentan-2-ol
CID 62606153
(2-hydroxy-4-phenylbutyl) carbamate
CID 67337427

Frequently Asked Questions

What is the IUPAC name of 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide?
The IUPAC name of 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide (CID 22628514) is 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide.
What is the SMILES notation for 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide?
The canonical SMILES for 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide is NC(=O)c1cn(CC(O)CCCc2ccccc2OCCCc2ccccc2)cn1.
What is the InChIKey of 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide?
The InChIKey is OMBMUISLHRVUOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O3/c25-24(29)22-17-27(18-26-22)16-21(28)13-6-12-20-11-4-5-14-23(20)30-15-7-10-19-8-2-1-3-9-19/h1-5,8-9,11,14,17-18,21,28H,6-7,10,12-13,15-16H2,(H2,25,29).
What are the key properties of 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide?
1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide has a molecular weight of 407.51 g/mol, XLogP of 3.38, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-hydroxy-5-[2-(3-phenylpropoxy)phenyl]pentyl]imidazole-4-carboxamide is sourced from PubChem (CID 22628514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).