2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride

C13H20Cl2N2O — CID 3047331

IUPAC2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride
SMILESCC(N)C(=O)NC(C)(C)Cc1ccc(Cl)cc1.Cl
InChIInChI=1S/C13H19ClN2O.ClH/c1-9(15)12(17)16-13(2,3)8-10-4-6-11(14)7-5-10;/h4-7,9H,8,15H2,1-3H3,(H,16,17);1H
InChIKeyQYSRCTPHVPXKCC-UHFFFAOYSA-N
MW291.22 g/mol
LogP2.55
Rot. Bonds4

About 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride

2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride (PubChem CID 3047331) has the molecular formula C13H20Cl2N2O and a molecular weight of 291.22 g/mol. Its IUPAC name is 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride
PubChem CID3047331
Molecular FormulaC13H20Cl2N2O
Molecular Weight291.22 g/mol
Exact Mass290.10
IUPAC Name2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride
SMILESCC(N)C(=O)NC(C)(C)Cc1ccc(Cl)cc1.Cl
InChIInChI=1S/C13H19ClN2O.ClH/c1-9(15)12(17)16-13(2,3)8-10-4-6-11(14)7-5-10;/h4-7,9H,8,15H2,1-3H3,(H,16,17);1H
InChIKeyQYSRCTPHVPXKCC-UHFFFAOYSA-N
XLogP2.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.22
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride 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-[2-(4-chlorophenyl)ethyl]-N'-isopropylethanediamide
CID 2290457
(2S,3S)-3-(4-chlorophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxobutan-2-aminium; 2,2,2-trifluoroacetate
CID 91895803
(2S)-2-(carbamoylamino)-N-[2-(4-chlorophenyl)ethyl]-3-methylbutanamide
CID 2117006
(2S)-2-(carbamoylamino)-N-[2-(2,4-dichlorophenyl)ethyl]-3-methylbutanamide
CID 2122018
(2S,3S)-2-(carbamoylamino)-N-[2-(4-chlorophenyl)ethyl]-3-methylpentanamide
CID 7905842
2-(4-chlorophenyl)-N-(2-methylbutan-2-yl)acetamide
CID 977625
(S)-2-amino-N-((S)-2-(4-chlorophenyl)-1-cyanoethyl)butanamide
CID 11817961
N-[(2R)-1-[4-(4-chlorophenyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]-4-methylpentanamide
CID 24758045
N-[(2R)-1-[4-(4-chlorophenyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]-3-methylbutanamide
CID 24758173
N-[(2R)-1-[4-(4-chlorophenyl)piperidin-1-yl]-1-oxobutan-2-yl]-3-methylbutanamide
CID 24758743
N-[1-[4-(4-chlorophenyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-methylpropanamide
CID 24759740
N-[2-(4-chlorophenyl)ethyl]acetamide
CID 9877644

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride?
The IUPAC name of 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride (CID 3047331) is 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride is CC(N)C(=O)NC(C)(C)Cc1ccc(Cl)cc1.Cl.
What is the InChIKey of 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride?
The InChIKey is QYSRCTPHVPXKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O.ClH/c1-9(15)12(17)16-13(2,3)8-10-4-6-11(14)7-5-10;/h4-7,9H,8,15H2,1-3H3,(H,16,17);1H.
What are the key properties of 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride?
2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride has a molecular weight of 291.22 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide;hydrochloride is sourced from PubChem (CID 3047331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).