2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide

C14H20N2O2 — CID 60873169

IUPAC2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide
SMILESCCOc1cccc(CNC(=O)CNC2CC2)c1
InChIInChI=1S/C14H20N2O2/c1-2-18-13-5-3-4-11(8-13)9-16-14(17)10-15-12-6-7-12/h3-5,8,12,15H,2,6-7,9-10H2,1H3,(H,16,17)
InChIKeyYLAONWNCIKARGG-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.45
Rot. Bonds7

About 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide

2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide (PubChem CID 60873169) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide
PubChem CID60873169
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide
SMILESCCOc1cccc(CNC(=O)CNC2CC2)c1
InChIInChI=1S/C14H20N2O2/c1-2-18-13-5-3-4-11(8-13)9-16-14(17)10-15-12-6-7-12/h3-5,8,12,15H,2,6-7,9-10H2,1H3,(H,16,17)
InChIKeyYLAONWNCIKARGG-UHFFFAOYSA-N
XLogP1.45
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(tert-butylamino)-N-[(3-ethoxyphenyl)methyl]acetamide
CID 112730361
2-(cyclopropylamino)-N-[[3-(methoxymethyl)phenyl]methyl]acetamide
CID 54896557
N-[(3-chlorophenyl)methyl]-2-(cyclopropylamino)acetamide
CID 60647316
2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide
CID 108993563
N-[2-[(3-ethoxyphenyl)methylamino]-2-oxoethyl]-3-fluorobenzamide
CID 78900659
3-[3-[(cyclopropylamino)methyl]phenoxy]-N-ethylpropanamide
CID 62324920
N-[(3-ethoxyphenyl)methyl]-4-hydroxybutanamide
CID 79191557
4-[(3-ethoxyphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120672581
N-[2-[(3-ethoxyphenyl)methylamino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide
CID 55844167
5-chloro-N-[(3-ethoxyphenyl)methyl]pentanamide
CID 60872587
N-[(3-ethoxyphenyl)methyl]-1,1-dioxothian-4-amine
CID 60873517
6-[(3-ethoxyphenyl)methylamino]-6-oxohexanoic acid
CID 60872975

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide (CID 60873169) is 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide is CCOc1cccc(CNC(=O)CNC2CC2)c1.
What is the InChIKey of 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide?
The InChIKey is YLAONWNCIKARGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-2-18-13-5-3-4-11(8-13)9-16-14(17)10-15-12-6-7-12/h3-5,8,12,15H,2,6-7,9-10H2,1H3,(H,16,17).
What are the key properties of 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide?
2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.45, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 60873169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).