2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide

C14H18ClNO2 — CID 11521853

IUPAC2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide
SMILESCC(C)(C(=O)NC1CCOC1)c1ccc(Cl)cc1
InChIInChI=1S/C14H18ClNO2/c1-14(2,10-3-5-11(15)6-4-10)13(17)16-12-7-8-18-9-12/h3-6,12H,7-9H2,1-2H3,(H,16,17)
InChIKeyNZNSSTIEANCFLR-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.52
Rot. Bonds3

About 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide

2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide (PubChem CID 11521853) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide
PubChem CID11521853
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Name2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide
SMILESCC(C)(C(=O)NC1CCOC1)c1ccc(Cl)cc1
InChIInChI=1S/C14H18ClNO2/c1-14(2,10-3-5-11(15)6-4-10)13(17)16-12-7-8-18-9-12/h3-6,12H,7-9H2,1-2H3,(H,16,17)
InChIKeyNZNSSTIEANCFLR-UHFFFAOYSA-N
XLogP2.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-N-cyclopentyl-2-methylpropanamide
CID 47300023
2,2-dimethyl-N-(oxolan-3-yl)propanamide
CID 58469645
2-methyl-2-[4-(oxolan-3-ylcarbamoylamino)phenyl]propanoic acid
CID 80549065
N-[2-(4-chlorophenyl)propan-2-yl]oxane-4-carboxamide
CID 113091859
3-amino-2,2-dimethyl-N-(oxolan-3-yl)propanamide
CID 80717739
1-(4-chlorophenyl)-1-(oxolan-3-yl)ethanol
CID 63563407
N-cyclopentyl-2-methyl-2-(4-methylphenyl)propanamide
CID 113198015
4-[[2-(4-chlorophenyl)-2-methylpropanoyl]amino]adamantane-1-carboxylic acid
CID 21099695
2-(4-fluorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
CID 119387447
2-amino-4-chloro-N-(oxolan-3-yl)benzamide
CID 80717146
N-[(6S)-2-amino-4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl]-2-(4-chlorophenyl)-2-methylpropanamide
CID 138003501
6-chloro-2-methyl-N-(oxolan-3-yl)pyridine-3-carboxamide
CID 168678063

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide?
The IUPAC name of 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide (CID 11521853) is 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide.
What is the SMILES notation for 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide?
The canonical SMILES for 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide is CC(C)(C(=O)NC1CCOC1)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide?
The InChIKey is NZNSSTIEANCFLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c1-14(2,10-3-5-11(15)6-4-10)13(17)16-12-7-8-18-9-12/h3-6,12H,7-9H2,1-2H3,(H,16,17).
What are the key properties of 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide?
2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide has a molecular weight of 267.76 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-methyl-N-(oxolan-3-yl)propanamide is sourced from PubChem (CID 11521853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).