2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide

C14H18N4O — CID 60861260

IUPAC2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide
SMILESCC(Cn1ccnc1)NC(=O)CNc1ccccc1
InChIInChI=1S/C14H18N4O/c1-12(10-18-8-7-15-11-18)17-14(19)9-16-13-5-3-2-4-6-13/h2-8,11-12,16H,9-10H2,1H3,(H,17,19)
InChIKeyLZRRFUSPLJICHA-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.50
Rot. Bonds6

About 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide

2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide (PubChem CID 60861260) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide
PubChem CID60861260
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide
SMILESCC(Cn1ccnc1)NC(=O)CNc1ccccc1
InChIInChI=1S/C14H18N4O/c1-12(10-18-8-7-15-11-18)17-14(19)9-16-13-5-3-2-4-6-13/h2-8,11-12,16H,9-10H2,1H3,(H,17,19)
InChIKeyLZRRFUSPLJICHA-UHFFFAOYSA-N
XLogP1.50
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-imidazol-1-ylpropan-2-ylamino)-2-oxoacetic acid
CID 61480681
3-amino-N-(1-imidazol-1-ylpropan-2-yl)-3-sulfanylidenepropanamide
CID 61482794
4-benzamido-N-[(2R)-1-imidazol-1-ylpropan-2-yl]benzamide
CID 94159344
2-(4-acetamidophenyl)-N-[(2S)-1-imidazol-1-ylpropan-2-yl]acetamide
CID 94024335
2-amino-N-(1-imidazol-1-ylpropan-2-yl)-2-phenylpropanamide;dihydrochloride
CID 120595679
3-(1-imidazol-1-ylpropan-2-ylcarbamoylamino)butanoic acid
CID 54957826
2-[4-(aminomethyl)phenyl]-N-(1-imidazol-1-ylpropan-2-yl)acetamide
CID 63588905
1-benzyl-3-(1-imidazol-1-ylpropan-2-yl)-1-methylurea
CID 47253391
2-anilino-N-(1-hydroxypropan-2-yl)acetamide
CID 60862778
1-[(2R)-1-imidazol-1-ylpropan-2-yl]-3-[(1-phenylcyclopropyl)methyl]urea
CID 94183170
3-[acetyl(benzyl)amino]-N-[(2R)-1-imidazol-1-ylpropan-2-yl]propanamide
CID 95300117
2-fluoro-N-[(2S)-1-imidazol-1-ylpropan-2-yl]benzamide
CID 93422582

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide?
The IUPAC name of 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide (CID 60861260) is 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide.
What is the SMILES notation for 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide?
The canonical SMILES for 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide is CC(Cn1ccnc1)NC(=O)CNc1ccccc1.
What is the InChIKey of 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide?
The InChIKey is LZRRFUSPLJICHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-12(10-18-8-7-15-11-18)17-14(19)9-16-13-5-3-2-4-6-13/h2-8,11-12,16H,9-10H2,1H3,(H,17,19).
What are the key properties of 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide?
2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide has a molecular weight of 258.32 g/mol, XLogP of 1.50, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-(1-imidazol-1-ylpropan-2-yl)acetamide is sourced from PubChem (CID 60861260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).