1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide

C15H20N2O3 — CID 15065034

IUPAC1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2(NC=O)CCCCC2)cc1
InChIInChI=1S/C15H20N2O3/c1-20-13-7-5-12(6-8-13)17-14(19)15(16-11-18)9-3-2-4-10-15/h5-8,11H,2-4,9-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyNEQXDZBMMXLQTQ-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.08
Rot. Bonds5

About 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide

1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide (PubChem CID 15065034) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
PubChem CID15065034
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
SMILESCOc1ccc(NC(=O)C2(NC=O)CCCCC2)cc1
InChIInChI=1S/C15H20N2O3/c1-20-13-7-5-12(6-8-13)17-14(19)15(16-11-18)9-3-2-4-10-15/h5-8,11H,2-4,9-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyNEQXDZBMMXLQTQ-UHFFFAOYSA-N
XLogP2.08
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

1-formamido-N-phenylcyclopentane-1-carboxamide
CID 15065028
1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 100729423
N-(4-methoxyphenyl)-1-propoxycycloheptane-1-carboxamide
CID 100713654
N-(4-methoxyphenyl)-3-methyl-1,5-dioxaspiro[5.5]undecane-3-carboxamide
CID 100779113
methyl 1-(4-methoxyanilino)cyclohexane-1-carboxylate
CID 54890159
1-(4-methoxyanilino)cyclohexane-1-carboxylate
CID 7018136
1-(4-methoxyanilino)cyclohexane-1-carboxamide
CID 2310511
1-(4-methoxyanilino)cycloheptane-1-carboxamide
CID 54889423
N-(4-methoxyphenyl)-2-methyloxirane-2-carboxamide
CID 87336938
N-(4-methoxyphenyl)-1-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 108971682
1-(2-fluorophenyl)-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
CID 100672872
N-(4-methoxyphenyl)spiro[2.3]hexane-2-carboxamide
CID 3967307

Frequently Asked Questions

What is the IUPAC name of 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide (CID 15065034) is 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide is COc1ccc(NC(=O)C2(NC=O)CCCCC2)cc1.
What is the InChIKey of 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide?
The InChIKey is NEQXDZBMMXLQTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-20-13-7-5-12(6-8-13)17-14(19)15(16-11-18)9-3-2-4-10-15/h5-8,11H,2-4,9-10H2,1H3,(H,16,18)(H,17,19).
What are the key properties of 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide?
1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-formamido-N-(4-methoxyphenyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 15065034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).