N-(4-aminophenyl)-N,2-dipropylpentanamide

C17H28N2O — CID 82983981

IUPACN-(4-aminophenyl)-N,2-dipropylpentanamide
SMILESCCCC(CCC)C(=O)N(CCC)c1ccc(N)cc1
InChIInChI=1S/C17H28N2O/c1-4-7-14(8-5-2)17(20)19(13-6-3)16-11-9-15(18)10-12-16/h9-12,14H,4-8,13,18H2,1-3H3
InChIKeyDTGJPIZLQAIXTD-UHFFFAOYSA-N
MW276.42 g/mol
LogP4.23
Rot. Bonds8

About N-(4-aminophenyl)-N,2-dipropylpentanamide

N-(4-aminophenyl)-N,2-dipropylpentanamide (PubChem CID 82983981) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-(4-aminophenyl)-N,2-dipropylpentanamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-N,2-dipropylpentanamide
PubChem CID82983981
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-(4-aminophenyl)-N,2-dipropylpentanamide
SMILESCCCC(CCC)C(=O)N(CCC)c1ccc(N)cc1
InChIInChI=1S/C17H28N2O/c1-4-7-14(8-5-2)17(20)19(13-6-3)16-11-9-15(18)10-12-16/h9-12,14H,4-8,13,18H2,1-3H3
InChIKeyDTGJPIZLQAIXTD-UHFFFAOYSA-N
XLogP4.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-[4-(aminomethyl)phenyl]-N,2-dipropylpentanamide
CID 82984391
1-(4-aminophenyl)-3-ethyl-1-propylurea
CID 63234160
N-(4-aminophenyl)-2-methoxy-N-propylacetamide
CID 63233545
N-(4-aminophenyl)-3,3,3-trifluoro-N-propylpropanamide
CID 63234191
N-(4-aminophenyl)-3,4,4-trimethyl-N-propylpentanamide
CID 63832151
N-(4-aminophenyl)-N-ethyl-2-methylhexanamide
CID 114245932
N-(4-aminophenyl)-2-(2-methylphenyl)-N-propylacetamide
CID 63234107
N-(4-aminophenyl)-N-propylthiophene-2-carboxamide
CID 63233977
2-(aminomethyl)-N-(2-cyanoethyl)-N-phenylpentanamide
CID 65225792
N-(4-aminophenyl)-N-propylpyridazine-4-carboxamide
CID 104669257
2-(4-amino-N-propylanilino)propanamide
CID 63233906
(4-aminophenyl)-icosylcarbamic acid
CID 57279079

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-N,2-dipropylpentanamide?
The IUPAC name of N-(4-aminophenyl)-N,2-dipropylpentanamide (CID 82983981) is N-(4-aminophenyl)-N,2-dipropylpentanamide.
What is the SMILES notation for N-(4-aminophenyl)-N,2-dipropylpentanamide?
The canonical SMILES for N-(4-aminophenyl)-N,2-dipropylpentanamide is CCCC(CCC)C(=O)N(CCC)c1ccc(N)cc1.
What is the InChIKey of N-(4-aminophenyl)-N,2-dipropylpentanamide?
The InChIKey is DTGJPIZLQAIXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-4-7-14(8-5-2)17(20)19(13-6-3)16-11-9-15(18)10-12-16/h9-12,14H,4-8,13,18H2,1-3H3.
What are the key properties of N-(4-aminophenyl)-N,2-dipropylpentanamide?
N-(4-aminophenyl)-N,2-dipropylpentanamide has a molecular weight of 276.42 g/mol, XLogP of 4.23, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-N,2-dipropylpentanamide is sourced from PubChem (CID 82983981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).