(2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride

C13H20Cl2N2O — CID 119297367

IUPAC(2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride
SMILESC[C@@H](N)C(=O)NCC(C)(C)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C13H19ClN2O.ClH/c1-9(15)12(17)16-8-13(2,3)10-4-6-11(14)7-5-10;/h4-7,9H,8,15H2,1-3H3,(H,16,17);1H/t9-;/m1./s1
InChIKeyBEYAUPCHQKMKCI-SBSPUUFOSA-N
MW291.22 g/mol
LogP2.50
Rot. Bonds4

About (2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride

(2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride (PubChem CID 119297367) has the molecular formula C13H20Cl2N2O and a molecular weight of 291.22 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride
PubChem CID119297367
Molecular FormulaC13H20Cl2N2O
Molecular Weight291.22 g/mol
Exact Mass290.10
IUPAC Name(2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride
SMILESC[C@@H](N)C(=O)NCC(C)(C)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C13H19ClN2O.ClH/c1-9(15)12(17)16-8-13(2,3)10-4-6-11(14)7-5-10;/h4-7,9H,8,15H2,1-3H3,(H,16,17);1H/t9-;/m1./s1
InChIKeyBEYAUPCHQKMKCI-SBSPUUFOSA-N
XLogP2.50
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 ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-3-methoxypropanamide;hydrochloride
CID 120986999
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide
CID 119738068
4-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]pentanamide;hydrochloride
CID 120560827
(2S)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-4-methylsulfanylbutanamide;hydrochloride
CID 119297358
1-[2-(4-chlorophenyl)-2-methylpropyl]-3-propan-2-ylurea
CID 47307554
2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide
CID 110460951
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119738056
3-[[2-(4-chlorophenyl)-2-methylpropyl]amino]-2-methylpropanoic acid
CID 115219650
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-sulfanylacetamide
CID 115167558
2-(4-aminophenyl)-N-[2-(4-chlorophenyl)-2-methylpropyl]acetamide;hydrochloride
CID 119738044
methyl 2-[[2-(4-chlorophenyl)-2-methylpropyl]amino]-2-oxoacetate
CID 115142659
3-chloro-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide
CID 110480800

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride?
The IUPAC name of (2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride (CID 119297367) is (2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride.
What is the SMILES notation for (2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride?
The canonical SMILES for (2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride is C[C@@H](N)C(=O)NCC(C)(C)c1ccc(Cl)cc1.Cl.
What is the InChIKey of (2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride?
The InChIKey is BEYAUPCHQKMKCI-SBSPUUFOSA-N. The full InChI is InChI=1S/C13H19ClN2O.ClH/c1-9(15)12(17)16-8-13(2,3)10-4-6-11(14)7-5-10;/h4-7,9H,8,15H2,1-3H3,(H,16,17);1H/t9-;/m1./s1.
What are the key properties of (2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride?
(2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride has a molecular weight of 291.22 g/mol, XLogP of 2.50, 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-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride is sourced from PubChem (CID 119297367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).