N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C16H23NO — CID 71620607

IUPACN-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCCc1ccccc1NC(=O)C1C(C)(C)C1(C)C
InChIInChI=1S/C16H23NO/c1-6-11-9-7-8-10-12(11)17-14(18)13-15(2,3)16(13,4)5/h7-10,13H,6H2,1-5H3,(H,17,18)
InChIKeyVRCXNJPSWRWCCV-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.87
Rot. Bonds3

About N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 71620607) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID71620607
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC NameN-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCCc1ccccc1NC(=O)C1C(C)(C)C1(C)C
InChIInChI=1S/C16H23NO/c1-6-11-9-7-8-10-12(11)17-14(18)13-15(2,3)16(13,4)5/h7-10,13H,6H2,1-5H3,(H,17,18)
InChIKeyVRCXNJPSWRWCCV-UHFFFAOYSA-N
XLogP3.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,4-N-bis(2-ethylphenyl)cyclohexane-1,4-dicarboxamide
CID 40704434
N-(2-ethylphenyl)cyclopentanecarboxamide
CID 897142
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-dicarboxamide
CID 4151337
N,N'-bis(2-ethylphenyl)propanediamide
CID 3881876
N-(2-ethylphenyl)-3-oxocyclobutane-1-carboxamide
CID 75395648
N-(2-carbamothioylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66477465
N-(2-ethylphenyl)-1,3,5-trithiane-2-carboxamide
CID 716587
N-[2-(N-hydroxy-C-methylcarbonimidoyl)phenyl]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 77115179
(1R,6R)-6-[(2-ethylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 790829
1-N-cyclopropyl-4-N-(2-ethylphenyl)cyclohexane-1,4-dicarboxamide
CID 109144748
6-[(2-ethylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 2865228
N-[2-(3-hydroxyprop-1-ynyl)phenyl]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66475991

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 71620607) is N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CCc1ccccc1NC(=O)C1C(C)(C)C1(C)C.
What is the InChIKey of N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is VRCXNJPSWRWCCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-6-11-9-7-8-10-12(11)17-14(18)13-15(2,3)16(13,4)5/h7-10,13H,6H2,1-5H3,(H,17,18).
What are the key properties of N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 245.37 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 71620607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).