N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide

C12H17NOS — CID 110698462

IUPACN,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide
SMILESCCN(CC)C(=O)C1(c2cccs2)CC1
InChIInChI=1S/C12H17NOS/c1-3-13(4-2)11(14)12(7-8-12)10-6-5-9-15-10/h5-6,9H,3-4,7-8H2,1-2H3
InChIKeyLIVIWUGZGOQSLJ-UHFFFAOYSA-N
MW223.34 g/mol
LogP2.65
Rot. Bonds4

About N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide

N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide (PubChem CID 110698462) has the molecular formula C12H17NOS and a molecular weight of 223.34 g/mol. Its IUPAC name is N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide
PubChem CID110698462
Molecular FormulaC12H17NOS
Molecular Weight223.34 g/mol
Exact Mass223.10
IUPAC NameN,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide
SMILESCCN(CC)C(=O)C1(c2cccs2)CC1
InChIInChI=1S/C12H17NOS/c1-3-13(4-2)11(14)12(7-8-12)10-6-5-9-15-10/h5-6,9H,3-4,7-8H2,1-2H3
InChIKeyLIVIWUGZGOQSLJ-UHFFFAOYSA-N
XLogP2.65
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-N-methyl-1-thiophen-2-ylcyclopropane-1-carboxamide
CID 110698469
2-hydroxy-1-(1-thiophen-2-ylcyclopropyl)ethanone
CID 46913895
2-[methyl-(1-thiophen-2-ylcyclohexanecarbonyl)amino]acetic acid
CID 119172241
N',N'-dimethyl-1-thiophen-2-ylcyclopropane-1-carbohydrazide
CID 116848288
N,N-diphenyl-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435357
N,N-diethylthiophene-2-carboxamide
CID 962897
2-[ethyl-(1-phenylcyclopropanecarbonyl)amino]acetic acid
CID 54900888
CID 69259223
CID 69259223
N-[3-(dimethylamino)propyl]-1-thiophen-2-ylcyclopropane-1-carboxamide
CID 110698443
N,N-diethyl-4-phenylpiperidine-4-carboxamide
CID 22361711
N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide
CID 113198157
2-chloro-1-(1-thiophen-2-ylcyclopentyl)ethanone
CID 131564842

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide?
The IUPAC name of N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide (CID 110698462) is N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide.
What is the SMILES notation for N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide?
The canonical SMILES for N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide is CCN(CC)C(=O)C1(c2cccs2)CC1.
What is the InChIKey of N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide?
The InChIKey is LIVIWUGZGOQSLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NOS/c1-3-13(4-2)11(14)12(7-8-12)10-6-5-9-15-10/h5-6,9H,3-4,7-8H2,1-2H3.
What are the key properties of N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide?
N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide has a molecular weight of 223.34 g/mol, XLogP of 2.65, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-thiophen-2-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 110698462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).