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

C13H19ClN2O — CID 163242373

IUPAC(2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide
SMILESC[C@@H](N)C(=O)NC(C)(C)Cc1ccc(Cl)cc1
InChIInChI=1S/C13H19ClN2O/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)/t9-/m1/s1
InChIKeyZNGZJIRQZDJUQR-SECBINFHSA-N
MW254.76 g/mol
LogP2.12
Rot. Bonds4

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

(2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide (PubChem CID 163242373) has the molecular formula C13H19ClN2O and a molecular weight of 254.76 g/mol. Its IUPAC name is (2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide
PubChem CID163242373
Molecular FormulaC13H19ClN2O
Molecular Weight254.76 g/mol
Exact Mass254.12
IUPAC Name(2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide
SMILESC[C@@H](N)C(=O)NC(C)(C)Cc1ccc(Cl)cc1
InChIInChI=1S/C13H19ClN2O/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)/t9-/m1/s1
InChIKeyZNGZJIRQZDJUQR-SECBINFHSA-N
XLogP2.12
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[1-(3,4-difluorophenyl)-2-methylpropan-2-yl]propanamide
CID 118878544
(2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide
CID 78973575
(2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride
CID 119297367
methyl 4-(4-chlorophenyl)-3-hydroxy-3-methyl-2-propan-2-ylbutanoate
CID 114081535
(2R)-2-amino-N-(4-chlorophenyl)propanamide
CID 7183165
tert-butyl N-[(1S)-2-[[1-(4-chlorophenyl)-2-methylpropan-2-yl]amino]-2-oxo-1-phenylethyl]carbamate
CID 163242383
(2R)-2-amino-N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]propanamide
CID 119835947
(2S)-2-amino-N-[2-(4-ethylphenyl)propan-2-yl]propanamide
CID 119337733
(4-chlorophenyl)methyl (2S)-2-aminopropanoate
CID 54528186
2-chloro-4-(4-chlorophenyl)-3,3-dimethylbutanamide
CID 140676450
2-amino-N-[1-(4-bromophenyl)-2-methylpropan-2-yl]pentanamide;hydrochloride
CID 119317253
N-tert-butyl-2-[(4-chlorophenyl)methylsulfonyl]propanamide
CID 47162619

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide?
The IUPAC name of (2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide (CID 163242373) is (2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide is C[C@@H](N)C(=O)NC(C)(C)Cc1ccc(Cl)cc1.
What is the InChIKey of (2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide?
The InChIKey is ZNGZJIRQZDJUQR-SECBINFHSA-N. The full InChI is InChI=1S/C13H19ClN2O/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)/t9-/m1/s1.
What are the key properties of (2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide?
(2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide has a molecular weight of 254.76 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]propanamide is sourced from PubChem (CID 163242373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).