1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide

C15H21N3O3 — CID 119729055

IUPAC1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide
SMILESCCN(CC(=O)Nc1cccc(OC)c1)C(=O)C1(N)CC1
InChIInChI=1S/C15H21N3O3/c1-3-18(14(20)15(16)7-8-15)10-13(19)17-11-5-4-6-12(9-11)21-2/h4-6,9H,3,7-8,10,16H2,1-2H3,(H,17,19)
InChIKeyIRLDLFWAPNUEQX-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.97
Rot. Bonds6

About 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide

1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide (PubChem CID 119729055) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide
PubChem CID119729055
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide
SMILESCCN(CC(=O)Nc1cccc(OC)c1)C(=O)C1(N)CC1
InChIInChI=1S/C15H21N3O3/c1-3-18(14(20)15(16)7-8-15)10-13(19)17-11-5-4-6-12(9-11)21-2/h4-6,9H,3,7-8,10,16H2,1-2H3,(H,17,19)
InChIKeyIRLDLFWAPNUEQX-UHFFFAOYSA-N
XLogP0.97
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]-1-phenylcyclopentane-1-carboxamide
CID 112768106
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]propanamide
CID 43011197
2-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]-2-methylpentanamide
CID 119729089
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]-3,3-dimethylbutanamide
CID 43011201
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]thiophene-2-carboxamide
CID 26353614
4-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]pentanamide
CID 120559009
2-[ethyl-(2-phenoxyacetyl)amino]-N-(3-methoxyphenyl)acetamide
CID 9094787
ethyl 2-[ethyl-[2-(3-methoxyanilino)-2-oxoethyl]amino]acetate
CID 60674331
4-chloro-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]benzamide
CID 7958626
1-amino-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-N-ethylcyclopropane-1-carboxamide;hydrochloride
CID 119682005
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]oxane-4-carboxamide
CID 30839706
3-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119729065

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide (CID 119729055) is 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide is CCN(CC(=O)Nc1cccc(OC)c1)C(=O)C1(N)CC1.
What is the InChIKey of 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide?
The InChIKey is IRLDLFWAPNUEQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-3-18(14(20)15(16)7-8-15)10-13(19)17-11-5-4-6-12(9-11)21-2/h4-6,9H,3,7-8,10,16H2,1-2H3,(H,17,19).
What are the key properties of 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide?
1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 119729055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).