N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide

C14H19ClN2O2 — CID 91659506

IUPACN-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide
SMILESCc1cc(C(=O)N(CC(N)=O)CC(C)C)ccc1Cl
InChIInChI=1S/C14H19ClN2O2/c1-9(2)7-17(8-13(16)18)14(19)11-4-5-12(15)10(3)6-11/h4-6,9H,7-8H2,1-3H3,(H2,16,18)
InChIKeyMEXYNYMSQYXBQF-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.23
Rot. Bonds5

About N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide

N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide (PubChem CID 91659506) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide
PubChem CID91659506
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC NameN-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide
SMILESCc1cc(C(=O)N(CC(N)=O)CC(C)C)ccc1Cl
InChIInChI=1S/C14H19ClN2O2/c1-9(2)7-17(8-13(16)18)14(19)11-4-5-12(15)10(3)6-11/h4-6,9H,7-8H2,1-3H3,(H2,16,18)
InChIKeyMEXYNYMSQYXBQF-UHFFFAOYSA-N
XLogP2.23
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-oxoethyl)-3-hydroxy-4-methyl-N-(2-methylpropyl)benzamide
CID 55003400
N-(2-amino-2-oxoethyl)-4-chloro-N-(2-methylpropyl)-3-nitrobenzamide
CID 61052640
N-(2-amino-2-oxoethyl)-4-hydroxy-2-methyl-N-(2-methylpropyl)benzamide
CID 103865180
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103998556
3-bromo-4-chloro-N,N-bis(2-methylpropyl)benzamide
CID 107999335
2-[(2-amino-2-oxoethyl)-(4-chloro-3-fluorobenzoyl)amino]acetic acid
CID 107998136
1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide
CID 3616296
2-[(3-methylbenzoyl)-(2-methylpropyl)amino]acetic acid
CID 55133359
2-[[4-(2-amino-2-oxoethoxy)-3-methoxybenzoyl]-(2-methylpropyl)amino]acetic acid
CID 119192734
4-amino-N-[2-(dimethylamino)ethyl]-3-methyl-N-(2-methylpropyl)benzamide
CID 60954175
2-[(3-methoxy-4-methylbenzoyl)-(2-methylpropyl)amino]acetic acid
CID 62033906
N-(2-amino-2-oxoethyl)-2,5-dichloro-N-(3-methylbutyl)benzamide
CID 156846570

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide (CID 91659506) is N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide is Cc1cc(C(=O)N(CC(N)=O)CC(C)C)ccc1Cl.
What is the InChIKey of N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide?
The InChIKey is MEXYNYMSQYXBQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-9(2)7-17(8-13(16)18)14(19)11-4-5-12(15)10(3)6-11/h4-6,9H,7-8H2,1-3H3,(H2,16,18).
What are the key properties of N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide?
N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide has a molecular weight of 282.77 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-4-chloro-3-methyl-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 91659506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).