N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride

C14H21ClN2O — CID 119260686

IUPACN-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride
SMILESCc1ccccc1CC(=O)N(C)C1CCNC1.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-11-5-3-4-6-12(11)9-14(17)16(2)13-7-8-15-10-13;/h3-6,13,15H,7-10H2,1-2H3;1H
InChIKeyHUTGWSDFSHXMJU-UHFFFAOYSA-N
MW268.79 g/mol
LogP1.78
Rot. Bonds3

About N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride

N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride (PubChem CID 119260686) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride
PubChem CID119260686
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC NameN-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride
SMILESCc1ccccc1CC(=O)N(C)C1CCNC1.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-11-5-3-4-6-12(11)9-14(17)16(2)13-7-8-15-10-13;/h3-6,13,15H,7-10H2,1-2H3;1H
InChIKeyHUTGWSDFSHXMJU-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119553666
2-(2-bromophenyl)-N-methyl-N-piperidin-4-ylacetamide
CID 83749686
N-methyl-2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
CID 55027680
3-(2-methylphenyl)-N-propyl-N-pyrrolidin-3-ylpropanamide
CID 62367590
2-(3-chlorophenyl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119554353
N-methyl-2-(2-methylphenyl)sulfanyl-N-piperidin-4-ylacetamide;hydrochloride
CID 119442046
N-methyl-N-pyrrolidin-3-yl-2-[3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119553639
2-(2H-indazol-3-yl)-N-methyl-N-pyrrolidin-3-ylacetamide
CID 119552780
2-(2,5-dimethoxyphenyl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119552036
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-methyl-N-pyrrolidin-3-ylacetamide
CID 119550456
N-methyl-2-(4-phenylphenyl)-N-piperidin-4-ylacetamide;hydrochloride
CID 119441133
N-methyl-N-[(3S)-pyrrolidin-3-yl]-2-thiophen-3-ylacetamide
CID 71641161

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride?
The IUPAC name of N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride (CID 119260686) is N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride.
What is the SMILES notation for N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride?
The canonical SMILES for N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride is Cc1ccccc1CC(=O)N(C)C1CCNC1.Cl.
What is the InChIKey of N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride?
The InChIKey is HUTGWSDFSHXMJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O.ClH/c1-11-5-3-4-6-12(11)9-14(17)16(2)13-7-8-15-10-13;/h3-6,13,15H,7-10H2,1-2H3;1H.
What are the key properties of N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride?
N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride has a molecular weight of 268.79 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride is sourced from PubChem (CID 119260686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).