N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide

C19H20ClNO2 — CID 110438924

IUPACN-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)Nc2c(C)cc(C)cc2Cl)CC1
InChIInChI=1S/C19H20ClNO2/c1-12-10-13(2)17(15(20)11-12)21-18(22)19(8-9-19)14-6-4-5-7-16(14)23-3/h4-7,10-11H,8-9H2,1-3H3,(H,21,22)
InChIKeyUAAPBFPJWXDDAQ-UHFFFAOYSA-N
MW329.83 g/mol
LogP4.64
Rot. Bonds4

About N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide

N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide (PubChem CID 110438924) has the molecular formula C19H20ClNO2 and a molecular weight of 329.83 g/mol. Its IUPAC name is N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
PubChem CID110438924
Molecular FormulaC19H20ClNO2
Molecular Weight329.83 g/mol
Exact Mass329.12
IUPAC NameN-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)Nc2c(C)cc(C)cc2Cl)CC1
InChIInChI=1S/C19H20ClNO2/c1-12-10-13(2)17(15(20)11-12)21-18(22)19(8-9-19)14-6-4-5-7-16(14)23-3/h4-7,10-11H,8-9H2,1-3H3,(H,21,22)
InChIKeyUAAPBFPJWXDDAQ-UHFFFAOYSA-N
XLogP4.64
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.83
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chloro-2-methylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 110438923
1-N'-(2-chloro-4,6-dimethylphenyl)-1-N-[(2-methoxyphenyl)methyl]cyclopropane-1,1-dicarboxamide
CID 108976230
N-(3-chloro-4-methylphenyl)-1-(2-methoxyphenyl)cyclobutane-1-carboxamide
CID 110439021
N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 122356219
5-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]amino]-2-methylbenzoic acid
CID 119255092
3-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]amino]-4-methylbenzoic acid
CID 119219323
N'-(2-chloro-4,6-dimethylphenyl)-N-[(2-methoxyphenyl)methyl]propanediamide
CID 108946925
1-(2-methoxyphenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
CID 110439650
N-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 122355966
methyl 3-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]amino]benzoate
CID 110438930
1-(2-chlorophenyl)-N-(4-methoxy-3-methylphenyl)cyclohexane-1-carboxamide
CID 100676610
N-(2-chloro-4,6-dimethylphenyl)-3-[2-(2-methoxyphenyl)ethylamino]propanamide
CID 109025421

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide (CID 110438924) is N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide is COc1ccccc1C1(C(=O)Nc2c(C)cc(C)cc2Cl)CC1.
What is the InChIKey of N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide?
The InChIKey is UAAPBFPJWXDDAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClNO2/c1-12-10-13(2)17(15(20)11-12)21-18(22)19(8-9-19)14-6-4-5-7-16(14)23-3/h4-7,10-11H,8-9H2,1-3H3,(H,21,22).
What are the key properties of N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide?
N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide has a molecular weight of 329.83 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 110438924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).