1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide

C19H22N2O2 — CID 56745365

IUPAC1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide
SMILESCOc1ccc(C2(C(=O)N(C)C(C)c3cccnc3)CC2)cc1
InChIInChI=1S/C19H22N2O2/c1-14(15-5-4-12-20-13-15)21(2)18(22)19(10-11-19)16-6-8-17(23-3)9-7-16/h4-9,12-14H,10-11H2,1-3H3
InChIKeyMEZDJMKPCGLKKQ-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.34
Rot. Bonds5

About 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide

1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide (PubChem CID 56745365) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide
PubChem CID56745365
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide
SMILESCOc1ccc(C2(C(=O)N(C)C(C)c3cccnc3)CC2)cc1
InChIInChI=1S/C19H22N2O2/c1-14(15-5-4-12-20-13-15)21(2)18(22)19(10-11-19)16-6-8-17(23-3)9-7-16/h4-9,12-14H,10-11H2,1-3H3
InChIKeyMEZDJMKPCGLKKQ-UHFFFAOYSA-N
XLogP3.34
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-methoxyphenyl)-N-methyl-N-[(1R)-1-pyridin-3-ylethyl]-1H-pyrazole-5-carboxamide
CID 97138639
4-methoxy-N-methyl-N-(1-pyridin-3-ylethyl)pyridine-2-carboxamide
CID 90649462
1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide
CID 90649820
(2R)-2-[[4,4-difluoro-1-(4-methoxyphenyl)cyclohexanecarbonyl]-methylamino]-3-hydroxypropanoic acid
CID 151666218
(E)-4-(dimethylamino)-N-methyl-N-(1-pyridin-3-ylethyl)but-2-enamide
CID 146076991
(4-methoxyphenyl) 1-pyridin-3-ylcyclobutane-1-carboxylate
CID 166293705
N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]-2-methylpropanamide
CID 9156623
1-(4-methoxyphenyl)-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
CID 81407071
N-cyclopropyl-6-methoxy-N-[(1R)-1-pyridin-3-ylethyl]-1H-indole-2-carboxamide
CID 95145430
2-(4-methoxyanilino)-2-pyridin-3-ylacetamide
CID 54889099
N-methyl-5-phenoxy-N-[(1S)-1-pyridin-3-ylethyl]furan-2-carboxamide
CID 95216320
(Z)-3-(2-methoxyphenyl)-N-methyl-N-[(1R)-1-pyridin-3-ylethyl]but-2-enamide
CID 99894138

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide (CID 56745365) is 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide is COc1ccc(C2(C(=O)N(C)C(C)c3cccnc3)CC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide?
The InChIKey is MEZDJMKPCGLKKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-14(15-5-4-12-20-13-15)21(2)18(22)19(10-11-19)16-6-8-17(23-3)9-7-16/h4-9,12-14H,10-11H2,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide?
1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 3.34, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 56745365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).