N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide

C15H24N2O — CID 43720783

IUPACN,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide
SMILESCCC(CC)Nc1ccc(CC(=O)N(C)C)cc1
InChIInChI=1S/C15H24N2O/c1-5-13(6-2)16-14-9-7-12(8-10-14)11-15(18)17(3)4/h7-10,13,16H,5-6,11H2,1-4H3
InChIKeyGVVNZKIQKCATEH-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.92
Rot. Bonds6

About N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide

N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide (PubChem CID 43720783) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide
PubChem CID43720783
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide
SMILESCCC(CC)Nc1ccc(CC(=O)N(C)C)cc1
InChIInChI=1S/C15H24N2O/c1-5-13(6-2)16-14-9-7-12(8-10-14)11-15(18)17(3)4/h7-10,13,16H,5-6,11H2,1-4H3
InChIKeyGVVNZKIQKCATEH-UHFFFAOYSA-N
XLogP2.92
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide 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

N,N-dimethyl-2-[4-(propan-2-ylamino)phenyl]acetamide
CID 43720790
2-[4-[(2-chloroacetyl)amino]phenyl]-N,N-dimethylacetamide
CID 43699528
N,N-dimethyl-2-[4-[1-(1H-pyrazol-5-yl)ethylamino]phenyl]acetamide
CID 60971929
N,N-dimethyl-2-(4-methylphenyl)acetamide
CID 4048798
3-amino-N-[4-[2-(dimethylamino)-2-oxoethyl]phenyl]butanamide
CID 54924467
N-[4-[2-(dimethylamino)-2-oxoethyl]phenyl]-4-hydroxybutanamide
CID 79200620
2-[4-[1-(furan-2-yl)propan-2-ylamino]phenyl]-N,N-dimethylacetamide
CID 63085829
2-[4-(5-methylheptan-3-ylamino)phenyl]acetamide
CID 43724150
2-[4-[2-(dimethylamino)-2-oxoethyl]anilino]-N-(2-ethoxyphenyl)propanamide
CID 60542586
4-[4-[2-(dimethylamino)-2-oxoethyl]anilino]-2,2-dimethyl-4-oxobutanoic acid
CID 119133632
2-hydroxyethyl N-[4-[2-(dimethylamino)-2-oxoethyl]phenyl]carbamate
CID 79346617
ethyl N-[4-(pentan-3-ylamino)phenyl]carbamate
CID 43703992

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide?
The IUPAC name of N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide (CID 43720783) is N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide is CCC(CC)Nc1ccc(CC(=O)N(C)C)cc1.
What is the InChIKey of N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide?
The InChIKey is GVVNZKIQKCATEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-5-13(6-2)16-14-9-7-12(8-10-14)11-15(18)17(3)4/h7-10,13,16H,5-6,11H2,1-4H3.
What are the key properties of N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide?
N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide has a molecular weight of 248.37 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-(pentan-3-ylamino)phenyl]acetamide is sourced from PubChem (CID 43720783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).