N-(3-aminophenyl)-2-(dipropylamino)propanamide

C15H25N3O — CID 16778715

IUPACN-(3-aminophenyl)-2-(dipropylamino)propanamide
SMILESCCCN(CCC)C(C)C(=O)Nc1cccc(N)c1
InChIInChI=1S/C15H25N3O/c1-4-9-18(10-5-2)12(3)15(19)17-14-8-6-7-13(16)11-14/h6-8,11-12H,4-5,9-10,16H2,1-3H3,(H,17,19)
InChIKeyHWVGSKYRMCNYLP-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.72
Rot. Bonds7

About N-(3-aminophenyl)-2-(dipropylamino)propanamide

N-(3-aminophenyl)-2-(dipropylamino)propanamide (PubChem CID 16778715) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(3-aminophenyl)-2-(dipropylamino)propanamide.

Molecular Properties

Compound NameN-(3-aminophenyl)-2-(dipropylamino)propanamide
PubChem CID16778715
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(3-aminophenyl)-2-(dipropylamino)propanamide
SMILESCCCN(CCC)C(C)C(=O)Nc1cccc(N)c1
InChIInChI=1S/C15H25N3O/c1-4-9-18(10-5-2)12(3)15(19)17-14-8-6-7-13(16)11-14/h6-8,11-12H,4-5,9-10,16H2,1-3H3,(H,17,19)
InChIKeyHWVGSKYRMCNYLP-UHFFFAOYSA-N
XLogP2.72
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.72
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-(3-aminophenyl)-2-[cyclopropylmethyl(propyl)amino]propanamide
CID 43588029
2-[(2-amino-2-oxoethyl)-ethylamino]-N-(3-aminophenyl)propanamide
CID 103101365
N-(3-aminophenyl)-2-[3-(dimethylamino)propyl-ethylamino]propanamide
CID 102991480
N-(3-amino-4-methylphenyl)-2-(dipropylamino)propanamide
CID 82224877
3-[[1-(3-aminoanilino)-1-oxopropan-2-yl]-methylamino]propanoic acid
CID 82224712
(2S)-N-(3-aminophenyl)-2-methylbutanamide
CID 40788840
(2S)-N-(3-aminophenyl)-2-methylpentanamide
CID 40788842
(2R)-N-(3-aminophenyl)-2-methylpentanamide
CID 40788841
N-(3-aminophenyl)-2-[2-methoxyethyl(methyl)amino]propanamide
CID 61429180
N-(3-aminophenyl)-2-ethoxypropanamide
CID 16782214
N-(3-aminophenyl)-2-[butyl(ethyl)amino]-3-methylbutanamide
CID 82224645
N-(4-amino-2-methylphenyl)-2-(dipropylamino)propanamide
CID 16779619

Frequently Asked Questions

What is the IUPAC name of N-(3-aminophenyl)-2-(dipropylamino)propanamide?
The IUPAC name of N-(3-aminophenyl)-2-(dipropylamino)propanamide (CID 16778715) is N-(3-aminophenyl)-2-(dipropylamino)propanamide.
What is the SMILES notation for N-(3-aminophenyl)-2-(dipropylamino)propanamide?
The canonical SMILES for N-(3-aminophenyl)-2-(dipropylamino)propanamide is CCCN(CCC)C(C)C(=O)Nc1cccc(N)c1.
What is the InChIKey of N-(3-aminophenyl)-2-(dipropylamino)propanamide?
The InChIKey is HWVGSKYRMCNYLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-9-18(10-5-2)12(3)15(19)17-14-8-6-7-13(16)11-14/h6-8,11-12H,4-5,9-10,16H2,1-3H3,(H,17,19).
What are the key properties of N-(3-aminophenyl)-2-(dipropylamino)propanamide?
N-(3-aminophenyl)-2-(dipropylamino)propanamide has a molecular weight of 263.38 g/mol, XLogP of 2.72, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminophenyl)-2-(dipropylamino)propanamide is sourced from PubChem (CID 16778715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).