N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide

C14H20N2O — CID 43434265

IUPACN-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide
SMILESCc1ccc(CNCC(=O)NC2CC2)cc1C
InChIInChI=1S/C14H20N2O/c1-10-3-4-12(7-11(10)2)8-15-9-14(17)16-13-5-6-13/h3-4,7,13,15H,5-6,8-9H2,1-2H3,(H,16,17)
InChIKeyJWGLLLFVZCXGIQ-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.67
Rot. Bonds5

About N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide

N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide (PubChem CID 43434265) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide
PubChem CID43434265
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide
SMILESCc1ccc(CNCC(=O)NC2CC2)cc1C
InChIInChI=1S/C14H20N2O/c1-10-3-4-12(7-11(10)2)8-15-9-14(17)16-13-5-6-13/h3-4,7,13,15H,5-6,8-9H2,1-2H3,(H,16,17)
InChIKeyJWGLLLFVZCXGIQ-UHFFFAOYSA-N
XLogP1.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-2-[(4-iodophenyl)methylamino]acetamide
CID 65477363
N-cyclopropyl-2-[(4-hydroxy-3-methoxyphenyl)methylamino]acetamide
CID 43329464
2-[(3,4-dimethylphenyl)methylamino]-N-ethylacetamide
CID 43221669
N-[2-(cyclopropylamino)-2-oxoethyl]-4-(3,4-dimethylphenyl)butanamide
CID 110423518
N-cyclopropyl-2-[(4-methylsulfanylphenyl)methylamino]acetamide
CID 43401901
2-[(4-bromo-3-chlorophenyl)methylamino]-N-cyclopropylacetamide
CID 103581537
N-cyclohexyl-2-[(3-methylphenyl)methylamino]acetamide
CID 60903369
3-[[[2-(cyclopropylamino)-2-oxoethyl]amino]methyl]benzoic acid
CID 103239145
2-(3,4-dimethylphenyl)-N-(3-methylcyclopentyl)acetamide
CID 114550146
2-[(4-chloro-2-methylphenyl)methylamino]-N-cyclopropylacetamide
CID 113461466
1-cyclopropyl-N-[(3,4-dimethylphenyl)methyl]methanamine
CID 43434536
N-cyclopropyl-3-[(4-methylphenyl)methylamino]propanamide
CID 55090993

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide (CID 43434265) is N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide is Cc1ccc(CNCC(=O)NC2CC2)cc1C.
What is the InChIKey of N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide?
The InChIKey is JWGLLLFVZCXGIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-3-4-12(7-11(10)2)8-15-9-14(17)16-13-5-6-13/h3-4,7,13,15H,5-6,8-9H2,1-2H3,(H,16,17).
What are the key properties of N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide?
N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide has a molecular weight of 232.33 g/mol, XLogP of 1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(3,4-dimethylphenyl)methylamino]acetamide is sourced from PubChem (CID 43434265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).