N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide

C15H20N2O2 — CID 42907979

IUPACN,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide
SMILESCc1ccc(NC(=O)CN(C)C(=O)C2CC2C)cc1
InChIInChI=1S/C15H20N2O2/c1-10-4-6-12(7-5-10)16-14(18)9-17(3)15(19)13-8-11(13)2/h4-7,11,13H,8-9H2,1-3H3,(H,16,18)
InChIKeySTAKDDYEKNRTRN-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.05
Rot. Bonds4

About N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide

N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide (PubChem CID 42907979) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide
PubChem CID42907979
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide
SMILESCc1ccc(NC(=O)CN(C)C(=O)C2CC2C)cc1
InChIInChI=1S/C15H20N2O2/c1-10-4-6-12(7-5-10)16-14(18)9-17(3)15(19)13-8-11(13)2/h4-7,11,13H,8-9H2,1-3H3,(H,16,18)
InChIKeySTAKDDYEKNRTRN-UHFFFAOYSA-N
XLogP2.05
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,2R)-N-[2-(4-fluoroanilino)-2-oxoethyl]-N,2-dimethylcyclopropane-1-carboxamide
CID 9441278
trans-(1R,2R)-N-[2-(4-chloroanilino)-2-oxoethyl]-N,2-dimethylcyclopropane-1-carboxamide
CID 9417409
N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopentanecarboxamide
CID 2672753
cis-(1R,2S)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N,2-dimethylcyclopropane-1-carboxamide
CID 2650123
N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N,2-dimethylcyclopropane-1-carboxamide
CID 25162519
3-(4-fluorophenyl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]pyrazolidine-4-carboxamide
CID 75625270
2-[methyl-[2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]amino]-N-(4-methylphenyl)acetamide
CID 40696364
cis-(1S,2R)-N-[2-(2-chloroanilino)-2-oxoethyl]-N,2-dimethylcyclopropane-1-carboxamide
CID 38635337
2-[methyl-[[(1R,2S)-2-methylcyclohexyl]carbamothioyl]amino]-N-(4-methylphenyl)acetamide
CID 8742483
N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 38008538
N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2,3-dihydro-1-benzothiophene-2-carboxamide
CID 51310482
N,3-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]furan-2-carboxamide
CID 38005582

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide?
The IUPAC name of N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide (CID 42907979) is N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide.
What is the SMILES notation for N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide?
The canonical SMILES for N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide is Cc1ccc(NC(=O)CN(C)C(=O)C2CC2C)cc1.
What is the InChIKey of N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide?
The InChIKey is STAKDDYEKNRTRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10-4-6-12(7-5-10)16-14(18)9-17(3)15(19)13-8-11(13)2/h4-7,11,13H,8-9H2,1-3H3,(H,16,18).
What are the key properties of N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide?
N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 42907979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).