N-(cycloheptylideneamino)-3-methoxybenzamide

C15H20N2O2 — CID 3610862

IUPACN-(cycloheptylideneamino)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NN=C2CCCCCC2)c1
InChIInChI=1S/C15H20N2O2/c1-19-14-10-6-7-12(11-14)15(18)17-16-13-8-4-2-3-5-9-13/h6-7,10-11H,2-5,8-9H2,1H3,(H,17,18)
InChIKeyOIFQBNBOBPQTTJ-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.14
Rot. Bonds3

About N-(cycloheptylideneamino)-3-methoxybenzamide

N-(cycloheptylideneamino)-3-methoxybenzamide (PubChem CID 3610862) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(cycloheptylideneamino)-3-methoxybenzamide.

Molecular Properties

Compound NameN-(cycloheptylideneamino)-3-methoxybenzamide
PubChem CID3610862
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-(cycloheptylideneamino)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NN=C2CCCCCC2)c1
InChIInChI=1S/C15H20N2O2/c1-19-14-10-6-7-12(11-14)15(18)17-16-13-8-4-2-3-5-9-13/h6-7,10-11H,2-5,8-9H2,1H3,(H,17,18)
InChIKeyOIFQBNBOBPQTTJ-UHFFFAOYSA-N
XLogP3.14
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.14
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-(cyclododecylideneamino)-3-methylbenzamide
CID 4110960
N-(cycloheptylideneamino)-3-(1,1,2,2-tetrafluoroethoxy)benzamide
CID 4866547
3-methoxy-N-(1-phenylethylideneamino)benzamide
CID 955694
N-(2-bicyclo[2.2.1]heptanylideneamino)-3-methoxybenzamide
CID 4123679
N'-(3-methoxybenzoyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carbohydrazide
CID 9441649
N-(benzylideneamino)-3-methoxybenzamide
CID 3517169
N-cyclopropyl-3-methoxybenzamide
CID 900156
azepan-1-yl-(3-methoxyphenyl)methanone
CID 669437
3,5-dimethoxy-N-[(Z)-1-(3-methoxyphenyl)ethylideneamino]benzamide
CID 9461084
N-[(2-hydroxy-3,5-diiodophenyl)methylideneamino]-3-methoxybenzamide
CID 5194762
N-(butylideneamino)-3-methoxybenzamide
CID 4229837
3-methoxy-N-[(2-methyl-1-phenylpropylidene)amino]benzamide
CID 4152734

Frequently Asked Questions

What is the IUPAC name of N-(cycloheptylideneamino)-3-methoxybenzamide?
The IUPAC name of N-(cycloheptylideneamino)-3-methoxybenzamide (CID 3610862) is N-(cycloheptylideneamino)-3-methoxybenzamide.
What is the SMILES notation for N-(cycloheptylideneamino)-3-methoxybenzamide?
The canonical SMILES for N-(cycloheptylideneamino)-3-methoxybenzamide is COc1cccc(C(=O)NN=C2CCCCCC2)c1.
What is the InChIKey of N-(cycloheptylideneamino)-3-methoxybenzamide?
The InChIKey is OIFQBNBOBPQTTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-19-14-10-6-7-12(11-14)15(18)17-16-13-8-4-2-3-5-9-13/h6-7,10-11H,2-5,8-9H2,1H3,(H,17,18).
What are the key properties of N-(cycloheptylideneamino)-3-methoxybenzamide?
N-(cycloheptylideneamino)-3-methoxybenzamide has a molecular weight of 260.34 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cycloheptylideneamino)-3-methoxybenzamide is sourced from PubChem (CID 3610862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).