N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide

C13H19NO — CID 60631160

IUPACN-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide
SMILESCC(=O)N(C)Cc1ccc(C(C)C)cc1
InChIInChI=1S/C13H19NO/c1-10(2)13-7-5-12(6-8-13)9-14(4)11(3)15/h5-8,10H,9H2,1-4H3
InChIKeyFEEHYHVEMVFQFL-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.79
Rot. Bonds3

About N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide

N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide (PubChem CID 60631160) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide
PubChem CID60631160
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide
SMILESCC(=O)N(C)Cc1ccc(C(C)C)cc1
InChIInChI=1S/C13H19NO/c1-10(2)13-7-5-12(6-8-13)9-14(4)11(3)15/h5-8,10H,9H2,1-4H3
InChIKeyFEEHYHVEMVFQFL-UHFFFAOYSA-N
XLogP2.79
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[4-[[acetyl(methyl)amino]methyl]phenyl]methyl]-N-methylacetamide
CID 20593123
1,3-dimethyl-1-[(4-propan-2-ylphenyl)methyl]urea
CID 47127099
methyl N-methyl-N-[(4-propan-2-ylphenyl)methyl]carbamate
CID 115190583
3-[methyl-[(4-propan-2-ylphenyl)methyl]amino]-3-oxopropanoic acid
CID 62231087
3-amino-N,2-dimethyl-N-[(4-propan-2-ylphenyl)methyl]propanamide
CID 62671042
2-hydroxyethyl N-methyl-N-[(4-propan-2-ylphenyl)methyl]carbamate
CID 79345773
N-methyl-N-[(5-propan-2-yl-2-pyridinyl)methyl]acetamide
CID 70912611
2-amino-N-methyl-N-[(4-propan-2-ylphenyl)methyl]cyclopropane-1-carboxamide
CID 114997651
3-cyano-N-methyl-N-[(4-propan-2-ylphenyl)methyl]propanamide
CID 94688472
1-amino-N-methyl-N-[(4-propan-2-ylphenyl)methyl]cyclopropane-1-carboxamide;hydrochloride
CID 119681945
benzyl N-methyl-N-[(4-propan-2-ylphenyl)methyl]carbamate
CID 118284724
2-iodo-N-methyl-N-[(4-propan-2-ylphenyl)methyl]benzamide
CID 60631043

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide?
The IUPAC name of N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide (CID 60631160) is N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide.
What is the SMILES notation for N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide?
The canonical SMILES for N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide is CC(=O)N(C)Cc1ccc(C(C)C)cc1.
What is the InChIKey of N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide?
The InChIKey is FEEHYHVEMVFQFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(2)13-7-5-12(6-8-13)9-14(4)11(3)15/h5-8,10H,9H2,1-4H3.
What are the key properties of N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide?
N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide has a molecular weight of 205.30 g/mol, XLogP of 2.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide is sourced from PubChem (CID 60631160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).