2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide

C14H20N2O — CID 56812522

IUPAC2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide
SMILESCCc1ccc(CN(CC(N)=O)C2CC2)cc1
InChIInChI=1S/C14H20N2O/c1-2-11-3-5-12(6-4-11)9-16(10-14(15)17)13-7-8-13/h3-6,13H,2,7-10H2,1H3,(H2,15,17)
InChIKeyLTXAUZPIDAVIMI-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.70
Rot. Bonds6

About 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide

2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide (PubChem CID 56812522) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide.

Molecular Properties

Compound Name2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide
PubChem CID56812522
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide
SMILESCCc1ccc(CN(CC(N)=O)C2CC2)cc1
InChIInChI=1S/C14H20N2O/c1-2-11-3-5-12(6-4-11)9-16(10-14(15)17)13-7-8-13/h3-6,13H,2,7-10H2,1H3,(H2,15,17)
InChIKeyLTXAUZPIDAVIMI-UHFFFAOYSA-N
XLogP1.70
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetic acid;hydrochloride
CID 170903356
2-[cyclopentyl-[(4-hydroxyphenyl)methyl]amino]acetamide
CID 82973746
2-[cyclopropyl(thiophen-3-ylmethyl)amino]acetamide
CID 47288219
2-[(4-aminophenyl)methyl-cyclopropylamino]-N,N-dimethylacetamide
CID 43384089
3-[(4-aminophenyl)methyl-cyclopropylamino]propanamide
CID 43460663
4-[[(4-aminocyclohexyl)-ethylamino]methyl]benzamide
CID 79115625
2-[[2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetyl]-methylamino]-N-(4-methylphenyl)acetamide
CID 55682363
ethyl 2-[cyclopropyl(pyridin-4-ylmethyl)amino]acetate
CID 60697552
N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-[(4-ethylphenyl)methyl]cyclopropanamine
CID 60500388
2-[cyclopropyl(propyl)amino]-1-(4-ethylphenyl)ethanone
CID 43795468
2-[[4-(aminomethyl)-2-methylphenyl]methyl-cyclopentylamino]acetamide
CID 114478704
N-[(4-ethylphenyl)methyl]-N-methylcyclopropanecarboxamide
CID 60630877

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide?
The IUPAC name of 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide (CID 56812522) is 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide.
What is the SMILES notation for 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide?
The canonical SMILES for 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide is CCc1ccc(CN(CC(N)=O)C2CC2)cc1.
What is the InChIKey of 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide?
The InChIKey is LTXAUZPIDAVIMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-2-11-3-5-12(6-4-11)9-16(10-14(15)17)13-7-8-13/h3-6,13H,2,7-10H2,1H3,(H2,15,17).
What are the key properties of 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide?
2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide has a molecular weight of 232.33 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[(4-ethylphenyl)methyl]amino]acetamide is sourced from PubChem (CID 56812522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).