N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide

C14H20N2O2 — CID 43713200

IUPACN-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1cccc(NC(C)C2CC2)c1
InChIInChI=1S/C14H20N2O2/c1-10(11-6-7-11)15-12-4-3-5-13(8-12)16-14(17)9-18-2/h3-5,8,10-11,15H,6-7,9H2,1-2H3,(H,16,17)
InChIKeyKIMLQKYXSRUXKC-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.48
Rot. Bonds6

About N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide

N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide (PubChem CID 43713200) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide
PubChem CID43713200
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1cccc(NC(C)C2CC2)c1
InChIInChI=1S/C14H20N2O2/c1-10(11-6-7-11)15-12-4-3-5-13(8-12)16-14(17)9-18-2/h3-5,8,10-11,15H,6-7,9H2,1-2H3,(H,16,17)
InChIKeyKIMLQKYXSRUXKC-UHFFFAOYSA-N
XLogP2.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(1-cyclohexylethylamino)phenyl]-2-methoxyacetamide
CID 43784509
[3-(1-cyclopropylethylamino)phenyl]urea
CID 43744613
2-methoxy-N-[3-(2-methylpentan-3-ylamino)phenyl]acetamide
CID 43784507
N-[3-[(2-methoxyacetyl)amino]phenyl]cyclohexanecarboxamide
CID 47022982
2-methoxy-N-[3-[[2-[(1R,2R)-2-methylcyclohexyl]oxyacetyl]amino]phenyl]acetamide
CID 96532685
2-methoxy-N-[3-[[2-[(1S,2R)-2-methylcyclohexyl]oxyacetyl]amino]phenyl]acetamide
CID 96532683
2-methoxy-N-[3-[[2-[(1S,2S)-2-methylcyclohexyl]oxyacetyl]amino]phenyl]acetamide
CID 96532684
N-[3-[1-(furan-2-yl)ethylamino]phenyl]-2-methoxyacetamide
CID 43713201
N-(3-aminophenyl)-2-methoxyacetamide
CID 11137720
N-[4-(dicyclopropylmethylamino)phenyl]-2-methoxyacetamide
CID 43717450
trans-(1R,2R)-N-[3-[(2-methoxyacetyl)amino]phenyl]-2-methylcyclopropane-1-carboxamide
CID 38397427
N-[3-[1-(oxolan-3-yl)ethylamino]phenyl]propanamide
CID 115917600

Frequently Asked Questions

What is the IUPAC name of N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide?
The IUPAC name of N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide (CID 43713200) is N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide.
What is the SMILES notation for N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide?
The canonical SMILES for N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide is COCC(=O)Nc1cccc(NC(C)C2CC2)c1.
What is the InChIKey of N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide?
The InChIKey is KIMLQKYXSRUXKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(11-6-7-11)15-12-4-3-5-13(8-12)16-14(17)9-18-2/h3-5,8,10-11,15H,6-7,9H2,1-2H3,(H,16,17).
What are the key properties of N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide?
N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide has a molecular weight of 248.33 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-cyclopropylethylamino)phenyl]-2-methoxyacetamide is sourced from PubChem (CID 43713200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).