trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide

C16H15ClN2O4S — CID 99577723

IUPACtrans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide
SMILESCOc1ccccc1[C@@H]1C[C@H]1C(=O)NS(=O)(=O)c1cncc(Cl)c1
InChIInChI=1S/C16H15ClN2O4S/c1-23-15-5-3-2-4-12(15)13-7-14(13)16(20)19-24(21,22)11-6-10(17)8-18-9-11/h2-6,8-9,13-14H,7H2,1H3,(H,19,20)/t13-,14+/m0/s1
InChIKeyBYERONGKLSSWQB-UONOGXRCSA-N
MW366.83 g/mol
LogP2.35
Rot. Bonds5

About trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide

trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide (PubChem CID 99577723) has the molecular formula C16H15ClN2O4S and a molecular weight of 366.83 g/mol. Its IUPAC name is trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Nametrans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide
PubChem CID99577723
Molecular FormulaC16H15ClN2O4S
Molecular Weight366.83 g/mol
Exact Mass366.04
IUPAC Nametrans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide
SMILESCOc1ccccc1[C@@H]1C[C@H]1C(=O)NS(=O)(=O)c1cncc(Cl)c1
InChIInChI=1S/C16H15ClN2O4S/c1-23-15-5-3-2-4-12(15)13-7-14(13)16(20)19-24(21,22)11-6-10(17)8-18-9-11/h2-6,8-9,13-14H,7H2,1H3,(H,19,20)/t13-,14+/m0/s1
InChIKeyBYERONGKLSSWQB-UONOGXRCSA-N
XLogP2.35
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.83
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R,3S)-N-[(5-chloro-3-pyridinyl)sulfonyl]-3-methyl-2,3-dihydro-1-benzofuran-2-carboxamide
CID 99578209
trans-(1R,2R)-2-(2-methoxyphenyl)-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]cyclopropane-1-carboxamide
CID 166236836
trans-(1R,2R)-N-[(2S)-2-(dimethylamino)-3-methylbutyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 98760900
N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2,6-dimethylphenyl)acetamide
CID 75509013
methyl 1-[[(1S,2S)-2-(2-methoxyphenyl)cyclopropanecarbonyl]amino]cyclohexane-1-carboxylate
CID 95278927
trans-(1R,2R)-N-(2-ethoxy-3-pyridinyl)-2-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 95279310
trans-(1S,2S)-2-(2-methoxyphenyl)-N-[3-(1,2,4-triazol-4-yl)phenyl]cyclopropane-1-carboxamide
CID 95283593
[(2R)-2-(4-chlorophenyl)azetidin-1-yl]-[(1R,2R)-2-(2-methoxyphenyl)cyclopropyl]methanone
CID 97217119
cis-(1R,2S)-2-(2-methoxyphenyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopropane-1-carboxamide
CID 95383107
cis-(1R,2S)-2-(2-methoxyphenyl)-N-[3-(2-methylpyrimidin-4-yl)phenyl]cyclopropane-1-carboxamide
CID 99800995
cis-(1S,2R)-2-(2-methoxyphenyl)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopropane-1-carboxamide
CID 95383104
cis-(1S,2R)-2-(2-methoxyphenyl)-N-[3-(2-methylpyrimidin-4-yl)phenyl]cyclopropane-1-carboxamide
CID 99801001

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide?
The IUPAC name of trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide (CID 99577723) is trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide is COc1ccccc1[C@@H]1C[C@H]1C(=O)NS(=O)(=O)c1cncc(Cl)c1.
What is the InChIKey of trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide?
The InChIKey is BYERONGKLSSWQB-UONOGXRCSA-N. The full InChI is InChI=1S/C16H15ClN2O4S/c1-23-15-5-3-2-4-12(15)13-7-14(13)16(20)19-24(21,22)11-6-10(17)8-18-9-11/h2-6,8-9,13-14H,7H2,1H3,(H,19,20)/t13-,14+/m0/s1.
What are the key properties of trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide?
trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide has a molecular weight of 366.83 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-N-[(5-chloro-3-pyridinyl)sulfonyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 99577723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).