2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide

C15H22N2O — CID 113304647

IUPAC2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)CNC(c1ccccc1)C1CC1
InChIInChI=1S/C15H22N2O/c1-3-17(2)14(18)11-16-15(13-9-10-13)12-7-5-4-6-8-12/h4-8,13,15-16H,3,9-11H2,1-2H3
InChIKeyUUOVXYIYWSRAGU-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.21
Rot. Bonds6

About 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide

2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide (PubChem CID 113304647) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide
PubChem CID113304647
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)CNC(c1ccccc1)C1CC1
InChIInChI=1S/C15H22N2O/c1-3-17(2)14(18)11-16-15(13-9-10-13)12-7-5-4-6-8-12/h4-8,13,15-16H,3,9-11H2,1-2H3
InChIKeyUUOVXYIYWSRAGU-UHFFFAOYSA-N
XLogP2.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[cyclopropyl(phenyl)methyl]amino]-N-phenyl-N-propan-2-ylacetamide
CID 112806598
2-[[cyclopropyl(phenyl)methyl]amino]-N-methylacetamide
CID 60712191
ethyl 2-[[cyclohexyl(phenyl)methyl]amino]acetate
CID 60811477
2-[[(4-chlorophenyl)-cyclopropylmethyl]amino]-N-[2-(dimethylamino)-2-phenylethyl]acetamide
CID 112801601
2-(butan-2-ylamino)-N-[cyclopropyl(phenyl)methyl]acetamide
CID 60719795
N-[2-[[cyclopropyl(phenyl)methyl]amino]ethyl]-2-methylpropanamide
CID 61313757
4-[[cyclopropyl(phenyl)methyl]amino]butanoic acid
CID 61312384
3-[[cyclopropyl(phenyl)methyl]amino]propanamide
CID 60713317
N-[cyclopropyl(phenyl)methyl]-1-ethylsulfonylpropan-2-amine
CID 115898623
N-[cyclopropyl(phenyl)methyl]-2-ethoxyethanamine
CID 61311612
N-[cyclobutyl(phenyl)methyl]ethanamine
CID 43489136
N-(3-chloro-2-methylphenyl)-2-[[cyclopropyl(phenyl)methyl]amino]acetamide
CID 112806311

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide?
The IUPAC name of 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide (CID 113304647) is 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide is CCN(C)C(=O)CNC(c1ccccc1)C1CC1.
What is the InChIKey of 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide?
The InChIKey is UUOVXYIYWSRAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-17(2)14(18)11-16-15(13-9-10-13)12-7-5-4-6-8-12/h4-8,13,15-16H,3,9-11H2,1-2H3.
What are the key properties of 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide?
2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide has a molecular weight of 246.35 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropyl(phenyl)methyl]amino]-N-ethyl-N-methylacetamide is sourced from PubChem (CID 113304647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).