1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide

C16H15ClN2O3S — CID 122174771

IUPAC1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide
SMILESCc1cccc(NC(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CC2)n1
InChIInChI=1S/C16H15ClN2O3S/c1-11-3-2-4-14(18-11)19-15(20)16(9-10-16)23(21,22)13-7-5-12(17)6-8-13/h2-8H,9-10H2,1H3,(H,18,19,20)
InChIKeyFEWRHRBBLRRSCN-UHFFFAOYSA-N
MW350.83 g/mol
LogP2.99
Rot. Bonds4

About 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide

1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide (PubChem CID 122174771) has the molecular formula C16H15ClN2O3S and a molecular weight of 350.83 g/mol. Its IUPAC name is 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide
PubChem CID122174771
Molecular FormulaC16H15ClN2O3S
Molecular Weight350.83 g/mol
Exact Mass350.05
IUPAC Name1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide
SMILESCc1cccc(NC(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CC2)n1
InChIInChI=1S/C16H15ClN2O3S/c1-11-3-2-4-14(18-11)19-15(20)16(9-10-16)23(21,22)13-7-5-12(17)6-8-13/h2-8H,9-10H2,1H3,(H,18,19,20)
InChIKeyFEWRHRBBLRRSCN-UHFFFAOYSA-N
XLogP2.99
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.83
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(benzenesulfonyl)-N-(5-chloropyridin-2-yl)propanamide
CID 3163448
3-(benzenesulfonyl)-N-(6-methylpyridin-2-yl)propanamide
CID 3163455
N~2~-[(4-chlorophenyl)sulfonyl]-N~2~-methyl-N~1~-(6-methyl-2-pyridinyl)glycinamide
CID 1301009
1-(4-chlorophenyl)sulfonyl-N-(6-methylpyridin-2-yl)pyrrolidine-2-carboxamide
CID 6459605
1-[(4-chlorophenyl)sulfonyl]-N-(6-methyl-2-pyridinyl)-4-piperidinecarboxamide
CID 6473361
1-(4-chlorophenyl)sulfonyl-N-(5-chloro-2-pyridinyl)cyclopropane-1-carboxamide
CID 15999338
N-(6-methyl-2-pyridyl)(5-chloro-2-thienyl)acetamide
CID 40805013
2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-quinolin-2-ylpropanamide
CID 24855718
2-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-N-(5-methyl-2-pyridinyl)propanamide
CID 24855720
2-(2,4-difluorophenyl)sulfonyl-2-methyl-N-[6-(trifluoromethyl)pyridin-2-yl]propanamide
CID 24855792
2-(4-fluorophenyl)sulfonyl-2-methyl-N-[6-(trifluoromethyl)pyridin-2-yl]propanamide
CID 24855837
2-(6-chloropyridin-3-yl)sulfonyl-2-methyl-N-[6-(trifluoromethyl)pyridin-2-yl]propanamide
CID 24855874

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide (CID 122174771) is 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide is Cc1cccc(NC(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CC2)n1.
What is the InChIKey of 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide?
The InChIKey is FEWRHRBBLRRSCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O3S/c1-11-3-2-4-14(18-11)19-15(20)16(9-10-16)23(21,22)13-7-5-12(17)6-8-13/h2-8H,9-10H2,1H3,(H,18,19,20).
What are the key properties of 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide?
1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide has a molecular weight of 350.83 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 122174771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).