N-acetyl-2-(2-methylphenyl)-N-propylacetamide

C14H19NO2 — CID 151742492

IUPACN-acetyl-2-(2-methylphenyl)-N-propylacetamide
SMILESCCCN(C(C)=O)C(=O)Cc1ccccc1C
InChIInChI=1S/C14H19NO2/c1-4-9-15(12(3)16)14(17)10-13-8-6-5-7-11(13)2/h5-8H,4,9-10H2,1-3H3
InChIKeyRMVBNJZOCDJYDN-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.32
Rot. Bonds4

About N-acetyl-2-(2-methylphenyl)-N-propylacetamide

N-acetyl-2-(2-methylphenyl)-N-propylacetamide (PubChem CID 151742492) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-acetyl-2-(2-methylphenyl)-N-propylacetamide.

Molecular Properties

Compound NameN-acetyl-2-(2-methylphenyl)-N-propylacetamide
PubChem CID151742492
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-acetyl-2-(2-methylphenyl)-N-propylacetamide
SMILESCCCN(C(C)=O)C(=O)Cc1ccccc1C
InChIInChI=1S/C14H19NO2/c1-4-9-15(12(3)16)14(17)10-13-8-6-5-7-11(13)2/h5-8H,4,9-10H2,1-3H3
InChIKeyRMVBNJZOCDJYDN-UHFFFAOYSA-N
XLogP2.32
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methylphenyl)-N,N-dipropylacetamide
CID 86977350
N-(2-hydroxyethyl)-2-(2-methylphenyl)-N-propylacetamide
CID 60656670
N-(4-aminophenyl)-2-(2-methylphenyl)-N-propylacetamide
CID 63234107
acetic acid;1-ethyl-2-methylbenzene
CID 67948051
N-ethyl-2-(2-methylphenyl)-N-phenylacetamide
CID 113098481
N-ethyl-N-(2-hydroxy-2-methylpropyl)-2-(2-methylphenyl)acetamide
CID 79386743
2-(2-methylphenyl)acetic acid
CID 67440217
2-(2-methylphenyl)ethyl-propylcarbamic acid
CID 144705989
2-(2-methylphenyl)-N-(piperidin-4-ylmethyl)-N-propylacetamide
CID 79702981
ethyl 2-[[2-(2-methylphenyl)acetyl]-propan-2-ylamino]acetate
CID 61021189
ethyl (2S)-2-methyl-3-(2-methylphenyl)propanoate
CID 125424870
1,2-bis(2-methylphenyl)ethanone
CID 11345119

Frequently Asked Questions

What is the IUPAC name of N-acetyl-2-(2-methylphenyl)-N-propylacetamide?
The IUPAC name of N-acetyl-2-(2-methylphenyl)-N-propylacetamide (CID 151742492) is N-acetyl-2-(2-methylphenyl)-N-propylacetamide.
What is the SMILES notation for N-acetyl-2-(2-methylphenyl)-N-propylacetamide?
The canonical SMILES for N-acetyl-2-(2-methylphenyl)-N-propylacetamide is CCCN(C(C)=O)C(=O)Cc1ccccc1C.
What is the InChIKey of N-acetyl-2-(2-methylphenyl)-N-propylacetamide?
The InChIKey is RMVBNJZOCDJYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-4-9-15(12(3)16)14(17)10-13-8-6-5-7-11(13)2/h5-8H,4,9-10H2,1-3H3.
What are the key properties of N-acetyl-2-(2-methylphenyl)-N-propylacetamide?
N-acetyl-2-(2-methylphenyl)-N-propylacetamide has a molecular weight of 233.31 g/mol, XLogP of 2.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-2-(2-methylphenyl)-N-propylacetamide is sourced from PubChem (CID 151742492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).