2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide

C15H23N3O2 — CID 75519630

IUPAC2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide
SMILESCCCN(C(=O)N(C)C)C(C)C(=O)Nc1ccccc1
InChIInChI=1S/C15H23N3O2/c1-5-11-18(15(20)17(3)4)12(2)14(19)16-13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3,(H,16,19)
InChIKeyRLVAXTMQOWQLFY-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.41
Rot. Bonds5

About 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide

2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide (PubChem CID 75519630) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide.

Molecular Properties

Compound Name2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide
PubChem CID75519630
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide
SMILESCCCN(C(=O)N(C)C)C(C)C(=O)Nc1ccccc1
InChIInChI=1S/C15H23N3O2/c1-5-11-18(15(20)17(3)4)12(2)14(19)16-13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3,(H,16,19)
InChIKeyRLVAXTMQOWQLFY-UHFFFAOYSA-N
XLogP2.41
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-anilino-1-oxopropan-2-yl)-2-methyl-N-propyl-1H-pyrrole-3-carboxamide
CID 122147154
1,1-dimethyl-3-(phenylcarbamoyl)-3-propylurea
CID 12876113
2-[[2-(cyclopropylmethylamino)acetyl]-propylamino]-N-phenylpropanamide;hydrochloride
CID 119763094
4-amino-N-(1-anilino-1-oxopropan-2-yl)-3-methoxy-N-propylbutanamide;hydrochloride
CID 120591026
3-[(1-anilino-1-oxopropan-2-yl)-propylamino]-2-methylpropanoic acid
CID 82326694
2-[1-hydroxypropan-2-yl(methyl)amino]-N-phenylpropanamide
CID 113426304
N-(1-anilino-1-oxopropan-2-yl)-N-propylpiperidine-3-carboxamide;hydrochloride
CID 119311611
2-[1-cyanopropan-2-yl(methyl)amino]-N-phenylpropanamide
CID 63224513
2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-phenylpropanamide
CID 79390383
2-[[2-oxo-2-(N-propan-2-ylanilino)ethyl]-propylamino]-N-phenylpropanamide
CID 60613531
N-phenyl-2-[propyl-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanamide
CID 47090603
2-methyl-N-phenylpentanamide
CID 4627801

Frequently Asked Questions

What is the IUPAC name of 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide?
The IUPAC name of 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide (CID 75519630) is 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide.
What is the SMILES notation for 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide?
The canonical SMILES for 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide is CCCN(C(=O)N(C)C)C(C)C(=O)Nc1ccccc1.
What is the InChIKey of 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide?
The InChIKey is RLVAXTMQOWQLFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-5-11-18(15(20)17(3)4)12(2)14(19)16-13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3,(H,16,19).
What are the key properties of 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide?
2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide has a molecular weight of 277.37 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dimethylcarbamoyl(propyl)amino]-N-phenylpropanamide is sourced from PubChem (CID 75519630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).