N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide

C14H21ClN2O — CID 61165845

IUPACN-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide
SMILESCc1ccc(Cl)cc1NC(=O)CNCC(C)(C)C
InChIInChI=1S/C14H21ClN2O/c1-10-5-6-11(15)7-12(10)17-13(18)8-16-9-14(2,3)4/h5-7,16H,8-9H2,1-4H3,(H,17,18)
InChIKeyVEODNSVLTFCZGQ-UHFFFAOYSA-N
MW268.79 g/mol
LogP3.22
Rot. Bonds4

About N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide

N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide (PubChem CID 61165845) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide
PubChem CID61165845
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC NameN-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide
SMILESCc1ccc(Cl)cc1NC(=O)CNCC(C)(C)C
InChIInChI=1S/C14H21ClN2O/c1-10-5-6-11(15)7-12(10)17-13(18)8-16-9-14(2,3)4/h5-7,16H,8-9H2,1-4H3,(H,17,18)
InChIKeyVEODNSVLTFCZGQ-UHFFFAOYSA-N
XLogP3.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-methylphenyl)-2-[(2-hydroxy-2-methylpropyl)amino]acetamide
CID 65106525
N-(5-chloro-2-methylphenyl)-2-[(2-hydroxy-4-methoxy-2-methylbutyl)amino]acetamide
CID 106255250
N,N'-bis(5-chloro-2-methylphenyl)propanediamide
CID 1340673
N-(5-chloro-2-methylphenyl)-2-[(4-chlorophenyl)methylamino]acetamide
CID 43405190
N-(5-chloro-2-methylphenyl)-2-(2-chloroprop-2-enylamino)acetamide
CID 113268604
2-(4-chloro-2-methylanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 26507073
N-(5-chloro-2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604822
N-(3-chlorophenyl)-2-(2,2-dimethylpropylamino)acetamide
CID 61168620
2-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]amino]-2-methylbutanoic acid
CID 79791570
3-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]amino]-N-ethylpropanamide
CID 115745425
N-(5-chloro-2-methylphenyl)-2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]acetamide
CID 79352093
N-(5-chloro-2-methylphenyl)-2-[3-(dimethylamino)propylamino]acetamide
CID 43405018

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide (CID 61165845) is N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide is Cc1ccc(Cl)cc1NC(=O)CNCC(C)(C)C.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide?
The InChIKey is VEODNSVLTFCZGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O/c1-10-5-6-11(15)7-12(10)17-13(18)8-16-9-14(2,3)4/h5-7,16H,8-9H2,1-4H3,(H,17,18).
What are the key properties of N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide?
N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide has a molecular weight of 268.79 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-2-(2,2-dimethylpropylamino)acetamide is sourced from PubChem (CID 61165845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).