N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide

C15H19NO — CID 76600124

IUPACN-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide
SMILESCCN(CC=Cc1ccccc1)C(=O)C1CC1
InChIInChI=1S/C15H19NO/c1-2-16(15(17)14-10-11-14)12-6-9-13-7-4-3-5-8-13/h3-9,14H,2,10-12H2,1H3
InChIKeyKHJBGNAJEYVKBT-UHFFFAOYSA-N
MW229.32 g/mol
LogP2.96
Rot. Bonds5

About N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide

N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide (PubChem CID 76600124) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide
PubChem CID76600124
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC NameN-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide
SMILESCCN(CC=Cc1ccccc1)C(=O)C1CC1
InChIInChI=1S/C15H19NO/c1-2-16(15(17)14-10-11-14)12-6-9-13-7-4-3-5-8-13/h3-9,14H,2,10-12H2,1H3
InChIKeyKHJBGNAJEYVKBT-UHFFFAOYSA-N
XLogP2.96
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-N-[(E)-3-phenylprop-2-enyl]oxolane-3-carboxamide
CID 50962275
N-ethyl-2-methyl-N-[(Z)-3-phenylprop-2-enyl]butanamide
CID 122692160
cis-(1R,3S)-3-amino-N-(3-hydroxypropyl)-N-[(E)-3-phenylprop-2-enyl]cyclopentane-1-carboxamide
CID 133119161
2-[3-(dimethylamino)pyrrolidin-1-yl]-N-ethyl-N-[(E)-3-phenylprop-2-enyl]acetamide
CID 91841784
N,N-diethyl-4-phenylbut-3-enamide
CID 71333088
(2R)-2-amino-N-ethyl-3-phenyl-N-[(E)-3-phenylprop-2-enyl]propanamide
CID 50984163
N,N-bis[(E)-3-phenylprop-2-enyl]benzamide
CID 139601549
N-ethyl-2-(methylamino)-N-(3-phenylprop-2-enyl)pyrimidine-5-carboxamide
CID 171134990
N-ethyl-2-(2-methoxyphenyl)-N-[(E)-3-phenylprop-2-enyl]acetamide
CID 46995618
N,N-diethyl-2-oxo-4-phenylbut-3-enamide
CID 57095227
N-benzyl-N-ethylcyclobutanecarboxamide
CID 110755489
1-N-benzyl-1-N-ethyl-4-N,4-N-dipropylcyclohexane-1,4-dicarboxamide
CID 109148640

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide?
The IUPAC name of N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide (CID 76600124) is N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide.
What is the SMILES notation for N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide?
The canonical SMILES for N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide is CCN(CC=Cc1ccccc1)C(=O)C1CC1.
What is the InChIKey of N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide?
The InChIKey is KHJBGNAJEYVKBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-2-16(15(17)14-10-11-14)12-6-9-13-7-4-3-5-8-13/h3-9,14H,2,10-12H2,1H3.
What are the key properties of N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide?
N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide has a molecular weight of 229.32 g/mol, XLogP of 2.96, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-phenylprop-2-enyl)cyclopropanecarboxamide is sourced from PubChem (CID 76600124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).