N-cyclohexyl-N-methyloxane-4-carboxamide

C13H23NO2 — CID 51074436

IUPACN-cyclohexyl-N-methyloxane-4-carboxamide
SMILESCN(C(=O)C1CCOCC1)C1CCCCC1
InChIInChI=1S/C13H23NO2/c1-14(12-5-3-2-4-6-12)13(15)11-7-9-16-10-8-11/h11-12H,2-10H2,1H3
InChIKeyLGMBGZXFTIORLD-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.20
Rot. Bonds2

About N-cyclohexyl-N-methyloxane-4-carboxamide

N-cyclohexyl-N-methyloxane-4-carboxamide (PubChem CID 51074436) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is N-cyclohexyl-N-methyloxane-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyloxane-4-carboxamide
PubChem CID51074436
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC NameN-cyclohexyl-N-methyloxane-4-carboxamide
SMILESCN(C(=O)C1CCOCC1)C1CCCCC1
InChIInChI=1S/C13H23NO2/c1-14(12-5-3-2-4-6-12)13(15)11-7-9-16-10-8-11/h11-12H,2-10H2,1H3
InChIKeyLGMBGZXFTIORLD-UHFFFAOYSA-N
XLogP2.20
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(Oxane-4-carbonyl)piperidine
CID 24229804
2-cyclohexyl-N-methyl-N-(tetrahydro-2H-pyran-4-ylmethyl)acetamide
CID 91915001
N-Methyl-N-[(oxan-4-YL)methyl]pentanamide
CID 91915004
N-Cyclohexyltetrahydro-2H-pyran-4-carboxamide
CID 60656377
N-methyl-N-(oxan-4-ylmethyl)butanamide
CID 64592636
N,N-dipropyloxane-4-carboxamide
CID 51073126
N-(2-methylcyclohexyl)oxane-4-carboxamide
CID 51073130
[(4S)-4-methylazepan-1-yl]-(oxan-4-yl)methanone
CID 95020952
(tetrahydro-2H-pyran-4-yl)(2-(trifluoromethyl)piperidin-1-yl)methanone
CID 92092589
N-cyclohexyl-2-fluoro-4-methoxy-N,2-dimethylbutanamide
CID 161884241
N-(4-methylcyclohexyl)oxane-4-carboxamide
CID 39958727
N-tert-butyl-N-ethyloxane-4-carboxamide
CID 58033950

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyloxane-4-carboxamide?
The IUPAC name of N-cyclohexyl-N-methyloxane-4-carboxamide (CID 51074436) is N-cyclohexyl-N-methyloxane-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-N-methyloxane-4-carboxamide?
The canonical SMILES for N-cyclohexyl-N-methyloxane-4-carboxamide is CN(C(=O)C1CCOCC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyloxane-4-carboxamide?
The InChIKey is LGMBGZXFTIORLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-14(12-5-3-2-4-6-12)13(15)11-7-9-16-10-8-11/h11-12H,2-10H2,1H3.
What are the key properties of N-cyclohexyl-N-methyloxane-4-carboxamide?
N-cyclohexyl-N-methyloxane-4-carboxamide has a molecular weight of 225.33 g/mol, XLogP of 2.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyloxane-4-carboxamide is sourced from PubChem (CID 51074436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).