N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide

C14H19N3O — CID 4206175

IUPACN-(cycloheptylideneamino)-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)NN=C1CCCCCC1
InChIInChI=1S/C14H19N3O/c18-14(10-12-6-5-9-15-11-12)17-16-13-7-3-1-2-4-8-13/h5-6,9,11H,1-4,7-8,10H2,(H,17,18)
InChIKeyFFDDBQNARDJDGH-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.45
Rot. Bonds3

About N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide

N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide (PubChem CID 4206175) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-(cycloheptylideneamino)-2-pyridin-3-ylacetamide
PubChem CID4206175
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC NameN-(cycloheptylideneamino)-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)NN=C1CCCCCC1
InChIInChI=1S/C14H19N3O/c18-14(10-12-6-5-9-15-11-12)17-16-13-7-3-1-2-4-8-13/h5-6,9,11H,1-4,7-8,10H2,(H,17,18)
InChIKeyFFDDBQNARDJDGH-UHFFFAOYSA-N
XLogP2.45
TPSA54.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(cycloheptylideneamino)pyridine-3-carboxamide
CID 4131498
CID 66868100
CID 66868100
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-3-ylacetamide
CID 107845575
N-(2-aminocycloheptyl)-2-pyridin-3-ylacetamide
CID 55169173
N-[(1S)-1-(cyclohexen-1-yl)ethyl]-2-pyridin-3-ylacetamide
CID 164643241
1-[[(2-pyridin-3-ylacetyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 115435809
N-[(4-chlorophenyl)methylideneamino]-2-pyridin-3-ylacetamide
CID 727974
2-pyridin-3-ylacetyl chloride
CID 14697475
N-(cyclohexylideneamino)-2-(4-phenylmethoxyphenoxy)acetamide
CID 29154497
2-(azepan-1-yl)-2-oxo-N-(pyridin-3-ylmethyl)acetamide
CID 108506694
2-[(2-pyridin-3-ylacetyl)amino]cyclopentane-1-carboxylic acid
CID 64813919
lithium;hydride;2-pyridin-3-ylacetic acid
CID 173026035

Frequently Asked Questions

What is the IUPAC name of N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide?
The IUPAC name of N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide (CID 4206175) is N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide?
The canonical SMILES for N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide is O=C(Cc1cccnc1)NN=C1CCCCCC1.
What is the InChIKey of N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide?
The InChIKey is FFDDBQNARDJDGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c18-14(10-12-6-5-9-15-11-12)17-16-13-7-3-1-2-4-8-13/h5-6,9,11H,1-4,7-8,10H2,(H,17,18).
What are the key properties of N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide?
N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide has a molecular weight of 245.33 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cycloheptylideneamino)-2-pyridin-3-ylacetamide is sourced from PubChem (CID 4206175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).