2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide

C7H11Cl2NO — CID 123206805

IUPAC2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide
SMILESCCN(C)C(=O)C1CC1(Cl)Cl
InChIInChI=1S/C7H11Cl2NO/c1-3-10(2)6(11)5-4-7(5,8)9/h5H,3-4H2,1-2H3
InChIKeyHJFFKNZMASNFQN-UHFFFAOYSA-N
MW196.08 g/mol
LogP1.66
Rot. Bonds2

About 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide

2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide (PubChem CID 123206805) has the molecular formula C7H11Cl2NO and a molecular weight of 196.08 g/mol. Its IUPAC name is 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide
PubChem CID123206805
Molecular FormulaC7H11Cl2NO
Molecular Weight196.08 g/mol
Exact Mass195.02
IUPAC Name2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide
SMILESCCN(C)C(=O)C1CC1(Cl)Cl
InChIInChI=1S/C7H11Cl2NO/c1-3-10(2)6(11)5-4-7(5,8)9/h5H,3-4H2,1-2H3
InChIKeyHJFFKNZMASNFQN-UHFFFAOYSA-N
XLogP1.66
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.08
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2,2-dichloro-N-ethyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
CID 78858761
N-butyl-2,2-dichloro-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
CID 78868725
2,2-dichloro-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
CID 78882931
(2,2-Dichloro-1-methylcyclopropyl)-pyrrolidin-1-ylmethanone
CID 4244250
1,2,2-trichloro-N,N-diethylcyclopropane-1-carboxamide
CID 20162053
2,2,3,3-tetrachloro-N,N-dimethylcyclopropane-1-carboxamide
CID 54160360
2,2,3-trichloro-N,N-dimethylcyclopropane-1-carboxamide
CID 67790561
2,2-dichloro-N,N-dimethylcyclopropane-1-carboxamide
CID 13218103
4-chloro-N-(cyclopropylmethyl)-N-methylbutanamide
CID 63307573
4-chloro-N-(cyclopropylmethyl)-N-propylbutanamide
CID 63309359
4-chloro-N-(cyclopropylmethyl)-N-ethylbutanamide
CID 63956164
2,2-dichloro-N,N-diethyl-1-methylcyclopropane-1-carboxamide
CID 78783668

Frequently Asked Questions

What is the IUPAC name of 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide?
The IUPAC name of 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide (CID 123206805) is 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide.
What is the SMILES notation for 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide?
The canonical SMILES for 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide is CCN(C)C(=O)C1CC1(Cl)Cl.
What is the InChIKey of 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide?
The InChIKey is HJFFKNZMASNFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11Cl2NO/c1-3-10(2)6(11)5-4-7(5,8)9/h5H,3-4H2,1-2H3.
What are the key properties of 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide?
2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide has a molecular weight of 196.08 g/mol, XLogP of 1.66, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dichloro-N-ethyl-N-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 123206805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).