N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide

C15H23N3O — CID 43568725

IUPACN-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide
SMILESCC(C(=O)Nc1ccccc1N)N(C)C(C)C1CC1
InChIInChI=1S/C15H23N3O/c1-10(12-8-9-12)18(3)11(2)15(19)17-14-7-5-4-6-13(14)16/h4-7,10-12H,8-9,16H2,1-3H3,(H,17,19)
InChIKeySCMAXADZMCRQDL-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.33
Rot. Bonds5

About N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide

N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide (PubChem CID 43568725) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide
PubChem CID43568725
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide
SMILESCC(C(=O)Nc1ccccc1N)N(C)C(C)C1CC1
InChIInChI=1S/C15H23N3O/c1-10(12-8-9-12)18(3)11(2)15(19)17-14-7-5-4-6-13(14)16/h4-7,10-12H,8-9,16H2,1-3H3,(H,17,19)
InChIKeySCMAXADZMCRQDL-UHFFFAOYSA-N
XLogP2.33
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-carbamothioylphenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide
CID 43569178
N-(2-cyanophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide
CID 43569136
N-(2-aminophenyl)-2-[cyclopropyl(propyl)amino]propanamide
CID 43270011
N-(2-aminophenyl)-2-[methyl-(1-methylpiperidin-3-yl)amino]propanamide
CID 62546374
N-(2-aminophenyl)-2-(dipropylamino)propanamide
CID 16778886
N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide
CID 119422452
N-(2-aminophenyl)-2-[methyl(2-methylbutyl)amino]propanamide
CID 43295395
(2R)-2-amino-N-(2-aminophenyl)propanamide;hydrochloride
CID 131153716
N-(2-aminophenyl)-2-cyclobutyloxypropanamide
CID 62116312
N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
CID 43526612
2-(2-aminophenyl)-N-(1-cyclopropylethyl)-N-methylacetamide
CID 43568611
2-[(2-amino-2-oxoethyl)-ethylamino]-N-(2-aminophenyl)propanamide
CID 103101404

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide?
The IUPAC name of N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide (CID 43568725) is N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide.
What is the SMILES notation for N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide?
The canonical SMILES for N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide is CC(C(=O)Nc1ccccc1N)N(C)C(C)C1CC1.
What is the InChIKey of N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide?
The InChIKey is SCMAXADZMCRQDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-10(12-8-9-12)18(3)11(2)15(19)17-14-7-5-4-6-13(14)16/h4-7,10-12H,8-9,16H2,1-3H3,(H,17,19).
What are the key properties of N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide?
N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide has a molecular weight of 261.37 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide is sourced from PubChem (CID 43568725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).