2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide

C15H19ClN2O2 — CID 49157849

IUPAC2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide
SMILESCCNC(=O)C(C)NC(=O)C1CC1c1cccc(Cl)c1
InChIInChI=1S/C15H19ClN2O2/c1-3-17-14(19)9(2)18-15(20)13-8-12(13)10-5-4-6-11(16)7-10/h4-7,9,12-13H,3,8H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyHYMAEJWRLVMXIW-UHFFFAOYSA-N
MW294.78 g/mol
LogP2.08
Rot. Bonds5

About 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide

2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide (PubChem CID 49157849) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide
PubChem CID49157849
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC Name2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide
SMILESCCNC(=O)C(C)NC(=O)C1CC1c1cccc(Cl)c1
InChIInChI=1S/C15H19ClN2O2/c1-3-17-14(19)9(2)18-15(20)13-8-12(13)10-5-4-6-11(16)7-10/h4-7,9,12-13H,3,8H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyHYMAEJWRLVMXIW-UHFFFAOYSA-N
XLogP2.08
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-(3-chlorophenyl)cyclopropanecarbonyl]amino]-4-methylpentanoic acid
CID 119188628
2-(3-chlorophenyl)-N-[2-(ethylamino)ethyl]cyclopropane-1-carboxamide;hydrochloride
CID 119506444
2-(3-chlorophenyl)-N-[2-(methylamino)propyl]cyclopropane-1-carboxamide;hydrochloride
CID 120829453
trans-(1R,2R)-2-(3-chlorophenyl)-N-[(2S,3S)-4-hydroxy-3-methylsulfanylbutan-2-yl]cyclopropane-1-carboxamide
CID 124778353
2-(3-chlorophenyl)-N-[2-(methylamino)ethyl]cyclopropane-1-carboxamide
CID 119501592
1-[(1S,2R)-2-(3-chlorophenyl)cyclopropyl]ethanone
CID 39239299
trans-(1S,2S)-2-(3-chlorophenyl)cyclopropane-1-carboxamide
CID 131139995
2-(3-chlorophenyl)cyclopropane-1-carboxylic acid
CID 23423018
cis-(1S,2R)-N-[2-(4-acetylpiperazin-1-yl)ethyl]-2-(3-chlorophenyl)cyclopropane-1-carboxamide
CID 95055116
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(3-chlorophenyl)cyclopropane-1-carboxamide
CID 119598536
methyl (2S)-2-[[(1S,2R)-2-(3,5-dichlorophenyl)cyclopropanecarbonyl]amino]propanoate
CID 124711462
2-(3-chlorophenyl)-N-[1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethyl]cyclopropane-1-carboxamide
CID 49161267

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide?
The IUPAC name of 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide (CID 49157849) is 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide is CCNC(=O)C(C)NC(=O)C1CC1c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide?
The InChIKey is HYMAEJWRLVMXIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c1-3-17-14(19)9(2)18-15(20)13-8-12(13)10-5-4-6-11(16)7-10/h4-7,9,12-13H,3,8H2,1-2H3,(H,17,19)(H,18,20).
What are the key properties of 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide?
2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide has a molecular weight of 294.78 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide is sourced from PubChem (CID 49157849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).