N-(cyclopropanecarbonyl)azepane-1-carboxamide

C11H18N2O2 — CID 110866290

IUPACN-(cyclopropanecarbonyl)azepane-1-carboxamide
SMILESO=C(NC(=O)N1CCCCCC1)C1CC1
InChIInChI=1S/C11H18N2O2/c14-10(9-5-6-9)12-11(15)13-7-3-1-2-4-8-13/h9H,1-8H2,(H,12,14,15)
InChIKeyFOZHUQHAEQPWIY-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.51
Rot. Bonds1

About N-(cyclopropanecarbonyl)azepane-1-carboxamide

N-(cyclopropanecarbonyl)azepane-1-carboxamide (PubChem CID 110866290) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(cyclopropanecarbonyl)azepane-1-carboxamide.

Molecular Properties

Compound NameN-(cyclopropanecarbonyl)azepane-1-carboxamide
PubChem CID110866290
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-(cyclopropanecarbonyl)azepane-1-carboxamide
SMILESO=C(NC(=O)N1CCCCCC1)C1CC1
InChIInChI=1S/C11H18N2O2/c14-10(9-5-6-9)12-11(15)13-7-3-1-2-4-8-13/h9H,1-8H2,(H,12,14,15)
InChIKeyFOZHUQHAEQPWIY-UHFFFAOYSA-N
XLogP1.51
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(cyclopropanecarbonylamino)ethyl]azocane-1-carboxamide
CID 71940931
N-[2-(cyclopropanecarbonylamino)ethyl]azepane-1-carboxamide
CID 113223981
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
N-(2-aminoacetyl)piperidine-1-carboxamide
CID 70167153
cis-(1R,3S)-3-(azocane-1-carbonylamino)cyclopentane-1-carboxylic acid
CID 106324241
N-methoxyazocane-1-carboxamide
CID 130891205
4-(cyclohexanecarbonylamino)-N-cyclohexylpiperidine-1-carboxamide
CID 3218389
N-(3-chloropropanoyl)piperidine-1-carboxamide
CID 43146337
N-[4-(methylamino)cyclohexyl]piperidine-1-carboxamide
CID 79156160
N-[4-(methylamino)cyclohexyl]azepane-1-carboxamide
CID 79152452
N-(2-chloropropanoyl)piperidine-1-carboxamide
CID 43146338
N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide
CID 59031008

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropanecarbonyl)azepane-1-carboxamide?
The IUPAC name of N-(cyclopropanecarbonyl)azepane-1-carboxamide (CID 110866290) is N-(cyclopropanecarbonyl)azepane-1-carboxamide.
What is the SMILES notation for N-(cyclopropanecarbonyl)azepane-1-carboxamide?
The canonical SMILES for N-(cyclopropanecarbonyl)azepane-1-carboxamide is O=C(NC(=O)N1CCCCCC1)C1CC1.
What is the InChIKey of N-(cyclopropanecarbonyl)azepane-1-carboxamide?
The InChIKey is FOZHUQHAEQPWIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c14-10(9-5-6-9)12-11(15)13-7-3-1-2-4-8-13/h9H,1-8H2,(H,12,14,15).
What are the key properties of N-(cyclopropanecarbonyl)azepane-1-carboxamide?
N-(cyclopropanecarbonyl)azepane-1-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 1.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropanecarbonyl)azepane-1-carboxamide is sourced from PubChem (CID 110866290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).