2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide

C17H26N2O2 — CID 113167538

IUPAC2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(C(C)=O)c1cccc(C)c1
InChIInChI=1S/C17H26N2O2/c1-5-10-18(11-6-2)17(21)13-19(15(4)20)16-9-7-8-14(3)12-16/h7-9,12H,5-6,10-11,13H2,1-4H3
InChIKeyMWSIPMHYZZRHGM-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.00
Rot. Bonds7

About 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide

2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide (PubChem CID 113167538) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide
PubChem CID113167538
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(C(C)=O)c1cccc(C)c1
InChIInChI=1S/C17H26N2O2/c1-5-10-18(11-6-2)17(21)13-19(15(4)20)16-9-7-8-14(3)12-16/h7-9,12H,5-6,10-11,13H2,1-4H3
InChIKeyMWSIPMHYZZRHGM-UHFFFAOYSA-N
XLogP3.00
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113167645
2-(N-acetyl-3-methylanilino)-N-butyl-N-methylacetamide
CID 113167534
2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide
CID 109006691
2-(N-acetyl-3,4-dichloroanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113179532
N-(2-bromoprop-2-enyl)-N-(3-methylphenyl)acetamide
CID 121009695
2-(N-acetyl-4-chloroanilino)-N,N-dipropylacetamide
CID 113171553
2-[N-acetyl-4-(diethylamino)anilino]-N,N-dipropylacetamide
CID 113176880
2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-N,N-dipropylacetamide
CID 113178455
2-(N-acetyl-3-chloro-4-fluoroanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113172485
methyl 4-[acetyl-[2-(N-ethyl-3-methylanilino)-2-oxoethyl]amino]benzoate
CID 113176496
2-[N-acetyl-2,6-di(propan-2-yl)anilino]-N,N-dipropylacetamide
CID 113178595
N-[2-(N-acetyl-3-methylanilino)ethyl]butanamide
CID 113057406

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide?
The IUPAC name of 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide (CID 113167538) is 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide.
What is the SMILES notation for 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide?
The canonical SMILES for 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide is CCCN(CCC)C(=O)CN(C(C)=O)c1cccc(C)c1.
What is the InChIKey of 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide?
The InChIKey is MWSIPMHYZZRHGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-5-10-18(11-6-2)17(21)13-19(15(4)20)16-9-7-8-14(3)12-16/h7-9,12H,5-6,10-11,13H2,1-4H3.
What are the key properties of 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide?
2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide has a molecular weight of 290.41 g/mol, XLogP of 3.00, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide is sourced from PubChem (CID 113167538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).