N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide

C13H20N2O — CID 43672835

IUPACN-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NCC(C)C)cc1C
InChIInChI=1S/C13H20N2O/c1-9(2)8-14-12-5-6-13(10(3)7-12)15-11(4)16/h5-7,9,14H,8H2,1-4H3,(H,15,16)
InChIKeyXJIRZNKITVBEJW-UHFFFAOYSA-N
MW220.32 g/mol
LogP3.02
Rot. Bonds4

About N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide

N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide (PubChem CID 43672835) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide
PubChem CID43672835
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NCC(C)C)cc1C
InChIInChI=1S/C13H20N2O/c1-9(2)8-14-12-5-6-13(10(3)7-12)15-11(4)16/h5-7,9,14H,8H2,1-4H3,(H,15,16)
InChIKeyXJIRZNKITVBEJW-UHFFFAOYSA-N
XLogP3.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-fluoro-5-(2-methylpropylamino)phenyl]acetamide
CID 60928010
N-[4-(butan-2-ylamino)-2-methylphenyl]acetamide
CID 43672867
N-[2-methyl-4-(pentan-3-ylamino)phenyl]acetamide
CID 43672883
N-(4-chloro-2-methylphenyl)-5-(2-methylpropylamino)pyridine-2-carboxamide
CID 109181316
tert-butyl N-[2-(4-acetamido-3-methylanilino)propyl]carbamate
CID 103387940
N-[2-methyl-4-(thiadiazol-4-ylmethylamino)phenyl]acetamide
CID 43672907
N-[2-methyl-4-(pyrimidin-5-ylmethylamino)phenyl]acetamide
CID 62758402
N-(4-acetamido-3-methylphenyl)-2-(aminomethyl)-3-methylbutanamide
CID 65225971
N-[4-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-2-methylphenyl]acetamide
CID 43778979
N-(4-acetamido-3-methylphenyl)-2-aminobutanamide
CID 43698853
N-[4-[(5-fluoro-2-methylphenyl)methylamino]-2-methylphenyl]acetamide
CID 103943723
N-[4-[(3-bromo-4-methylphenyl)methylamino]-2-methylphenyl]acetamide
CID 115876095

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide?
The IUPAC name of N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide (CID 43672835) is N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide.
What is the SMILES notation for N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide?
The canonical SMILES for N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide is CC(=O)Nc1ccc(NCC(C)C)cc1C.
What is the InChIKey of N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide?
The InChIKey is XJIRZNKITVBEJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-9(2)8-14-12-5-6-13(10(3)7-12)15-11(4)16/h5-7,9,14H,8H2,1-4H3,(H,15,16).
What are the key properties of N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide?
N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide has a molecular weight of 220.32 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide is sourced from PubChem (CID 43672835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).