N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide

C16H16N2O2 — CID 3532731

IUPACN-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide
SMILESO=C(Nc1ncccc1OCc1ccccc1)C1CC1
InChIInChI=1S/C16H16N2O2/c19-16(13-8-9-13)18-15-14(7-4-10-17-15)20-11-12-5-2-1-3-6-12/h1-7,10,13H,8-9,11H2,(H,17,18,19)
InChIKeyCCXFWJRDEAWKKW-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.01
Rot. Bonds5

About N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide

N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide (PubChem CID 3532731) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide
PubChem CID3532731
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide
SMILESO=C(Nc1ncccc1OCc1ccccc1)C1CC1
InChIInChI=1S/C16H16N2O2/c19-16(13-8-9-13)18-15-14(7-4-10-17-15)20-11-12-5-2-1-3-6-12/h1-7,10,13H,8-9,11H2,(H,17,18,19)
InChIKeyCCXFWJRDEAWKKW-UHFFFAOYSA-N
XLogP3.01
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-phenylmethoxy-2-pyridinyl)carbamoylamino]benzoic acid
CID 11602993
1-phenyl-3-(3-phenylmethoxy-2-pyridinyl)thiourea
CID 11674430
2-phenoxy-N-(3-phenylmethoxy-2-pyridinyl)propanamide
CID 73441719
15-methyl-N-(3-phenylmethoxy-2-pyridinyl)tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15-carboxamide
CID 23595987
1-(3-phenylmethoxy-2-pyridinyl)-3-(2-propan-2-ylphenyl)urea
CID 11501398
1-(3-phenylmethoxy-2-pyridinyl)-3-propan-2-ylthiourea
CID 142715572
1-[2-(hydroxyamino)-2-oxoethyl]-N-(3-phenylmethoxy-2-pyridinyl)cyclohexane-1-carboxamide
CID 139789926
ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate
CID 139362692
4-[(3-chloro-2-pyridinyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 103094698
3,5-ditert-butyl-4-hydroxy-N-(3-phenylmethoxy-2-pyridinyl)benzamide
CID 139945086
N-[4-(4-phenylmethoxyanilino)phenyl]cyclopropanecarboxamide
CID 112988911
N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]-2-phenylacetamide
CID 84558977

Frequently Asked Questions

What is the IUPAC name of N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide?
The IUPAC name of N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide (CID 3532731) is N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide?
The canonical SMILES for N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide is O=C(Nc1ncccc1OCc1ccccc1)C1CC1.
What is the InChIKey of N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide?
The InChIKey is CCXFWJRDEAWKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c19-16(13-8-9-13)18-15-14(7-4-10-17-15)20-11-12-5-2-1-3-6-12/h1-7,10,13H,8-9,11H2,(H,17,18,19).
What are the key properties of N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide?
N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide has a molecular weight of 268.32 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenylmethoxy-2-pyridinyl)cyclopropanecarboxamide is sourced from PubChem (CID 3532731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).