1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide

C17H18N2O2 — CID 110439711

IUPAC1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)Nc2ccncc2)CCC1
InChIInChI=1S/C17H18N2O2/c1-21-15-6-3-2-5-14(15)17(9-4-10-17)16(20)19-13-7-11-18-12-8-13/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,18,19,20)
InChIKeyXJUJEPGTKBKYQS-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.15
Rot. Bonds4

About 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide

1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide (PubChem CID 110439711) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide
PubChem CID110439711
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)Nc2ccncc2)CCC1
InChIInChI=1S/C17H18N2O2/c1-21-15-6-3-2-5-14(15)17(9-4-10-17)16(20)19-13-7-11-18-12-8-13/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,18,19,20)
InChIKeyXJUJEPGTKBKYQS-UHFFFAOYSA-N
XLogP3.15
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetylphenyl)-1-(2-methoxyphenyl)cyclobutane-1-carboxamide
CID 110439041
methyl 4-[[1-(2-methoxyphenyl)cyclobutanecarbonyl]amino]benzoate
CID 110439045
1-(2-methoxyphenyl)-N-(3-methoxyphenyl)cyclobutane-1-carboxamide
CID 110439026
1-(2-methoxyphenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
CID 110439650
1-(2-methoxyphenyl)-N-(4-pyrrolidin-1-ylphenyl)cyclobutane-1-carboxamide
CID 110439047
N-(3-chloro-4-methylphenyl)-1-(2-methoxyphenyl)cyclobutane-1-carboxamide
CID 110439021
methyl 3-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]amino]benzoate
CID 110438930
1-(2-methoxyphenyl)-N-(2-phenoxypyrimidin-5-yl)cyclopropane-1-carboxamide
CID 122302324
5-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]amino]-2-methylbenzoic acid
CID 119255092
1-(2-methoxyphenyl)-N-prop-2-enylcyclobutane-1-carboxamide
CID 110486813
1-(2-methoxyphenyl)cyclohexane-1-carbohydrazide
CID 116844537
N-(1H-indazol-6-yl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 110438934

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide?
The IUPAC name of 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide (CID 110439711) is 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide?
The canonical SMILES for 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide is COc1ccccc1C1(C(=O)Nc2ccncc2)CCC1.
What is the InChIKey of 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide?
The InChIKey is XJUJEPGTKBKYQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-21-15-6-3-2-5-14(15)17(9-4-10-17)16(20)19-13-7-11-18-12-8-13/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,18,19,20).
What are the key properties of 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide?
1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-pyridin-4-ylcyclobutane-1-carboxamide is sourced from PubChem (CID 110439711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).