N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride

C13H20Cl2N2O — CID 119738056

IUPACN-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)NCC(C)(C)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C13H19ClN2O.ClH/c1-13(2,9-16-12(17)8-15-3)10-4-6-11(14)7-5-10;/h4-7,15H,8-9H2,1-3H3,(H,16,17);1H
InChIKeyKHAMWSYOPNBHMC-UHFFFAOYSA-N
MW291.22 g/mol
LogP2.38
Rot. Bonds5

About N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride

N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride (PubChem CID 119738056) has the molecular formula C13H20Cl2N2O and a molecular weight of 291.22 g/mol. Its IUPAC name is N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
PubChem CID119738056
Molecular FormulaC13H20Cl2N2O
Molecular Weight291.22 g/mol
Exact Mass290.10
IUPAC NameN-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)NCC(C)(C)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C13H19ClN2O.ClH/c1-13(2,9-16-12(17)8-15-3)10-4-6-11(14)7-5-10;/h4-7,15H,8-9H2,1-3H3,(H,16,17);1H
InChIKeyKHAMWSYOPNBHMC-UHFFFAOYSA-N
XLogP2.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.22
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(methylamino)-N-[2-methyl-2-(4-methylphenyl)propyl]acetamide
CID 115152154
N-[2-(4-ethylphenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119802083
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-sulfanylacetamide
CID 115167558
2-(methylamino)-N-(2-methyl-2-phenylpropyl)acetamide
CID 60986486
3-chloro-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide
CID 110480800
2-(4-aminophenyl)-N-[2-(4-chlorophenyl)-2-methylpropyl]acetamide;hydrochloride
CID 119738044
4-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]pentanamide;hydrochloride
CID 120560827
N-[2-(2-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride
CID 119773024
7-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]heptanamide
CID 119738039
2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methylpropanamide
CID 110460951
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide
CID 119738068
(2R)-2-amino-N-[2-(4-chlorophenyl)-2-methylpropyl]propanamide;hydrochloride
CID 119297367

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride?
The IUPAC name of N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride (CID 119738056) is N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride.
What is the SMILES notation for N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride?
The canonical SMILES for N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride is CNCC(=O)NCC(C)(C)c1ccc(Cl)cc1.Cl.
What is the InChIKey of N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride?
The InChIKey is KHAMWSYOPNBHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O.ClH/c1-13(2,9-16-12(17)8-15-3)10-4-6-11(14)7-5-10;/h4-7,15H,8-9H2,1-3H3,(H,16,17);1H.
What are the key properties of N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride?
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride has a molecular weight of 291.22 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenyl)-2-methylpropyl]-2-(methylamino)acetamide;hydrochloride is sourced from PubChem (CID 119738056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).