N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide

C20H22N4O — CID 75427147

IUPACN-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide
SMILESCCCn1ccnc1-c1cccc(NC(=O)CCc2ccccn2)c1
InChIInChI=1S/C20H22N4O/c1-2-13-24-14-12-22-20(24)16-6-5-8-18(15-16)23-19(25)10-9-17-7-3-4-11-21-17/h3-8,11-12,14-15H,2,9-10,13H2,1H3,(H,23,25)
InChIKeyUIPRQEYTYXVEON-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.93
Rot. Bonds7

About N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide

N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide (PubChem CID 75427147) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide.

Molecular Properties

Compound NameN-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide
PubChem CID75427147
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC NameN-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide
SMILESCCCn1ccnc1-c1cccc(NC(=O)CCc2ccccn2)c1
InChIInChI=1S/C20H22N4O/c1-2-13-24-14-12-22-20(24)16-6-5-8-18(15-16)23-19(25)10-9-17-7-3-4-11-21-17/h3-8,11-12,14-15H,2,9-10,13H2,1H3,(H,23,25)
InChIKeyUIPRQEYTYXVEON-UHFFFAOYSA-N
XLogP3.93
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[3-(1-butylimidazol-2-yl)phenyl]propanamide;dihydrochloride
CID 119896331
2-amino-N-[3-(1-butylimidazol-2-yl)phenyl]acetamide
CID 119896318
2-amino-N-[3-(1-butylimidazol-2-yl)phenyl]acetamide;dihydrochloride
CID 119896317
N-[3-[1-[2-(dimethylamino)ethyl]imidazol-2-yl]phenyl]acetamide
CID 82559432
N-(3-bromo-4-methylphenyl)-3-pyridin-2-ylpropanamide
CID 110389230
4-amino-N-[3-(1-methylimidazol-2-yl)phenyl]butanamide
CID 119856092
N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]-3-pyridin-2-ylpropanamide
CID 60599848
3-pyridin-2-yl-N-pyridin-3-ylpropanamide
CID 47468155
[3-(1-propylimidazol-2-yl)phenyl]methanamine
CID 63974354
N-(4-hydroxyphenyl)-3-pyridin-2-ylpropanamide
CID 80743821
3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide
CID 47468107
N-[4-[(1R)-1-(2-methylimidazol-1-yl)ethyl]phenyl]-3-pyridin-2-ylpropanamide
CID 171801254

Frequently Asked Questions

What is the IUPAC name of N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide?
The IUPAC name of N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide (CID 75427147) is N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide.
What is the SMILES notation for N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide?
The canonical SMILES for N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide is CCCn1ccnc1-c1cccc(NC(=O)CCc2ccccn2)c1.
What is the InChIKey of N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide?
The InChIKey is UIPRQEYTYXVEON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-2-13-24-14-12-22-20(24)16-6-5-8-18(15-16)23-19(25)10-9-17-7-3-4-11-21-17/h3-8,11-12,14-15H,2,9-10,13H2,1H3,(H,23,25).
What are the key properties of N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide?
N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide has a molecular weight of 334.42 g/mol, XLogP of 3.93, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide is sourced from PubChem (CID 75427147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).