(1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone

C15H27NO2 — CID 20549212

IUPAC(1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone
SMILESCCC1(C(=O)N2CCOCC2)CCCCCC1C
InChIInChI=1S/C15H27NO2/c1-3-15(8-6-4-5-7-13(15)2)14(17)16-9-11-18-12-10-16/h13H,3-12H2,1-2H3
InChIKeyGXJPZYMADTZIGF-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.84
Rot. Bonds2

About (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone

(1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone (PubChem CID 20549212) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone
PubChem CID20549212
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name(1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone
SMILESCCC1(C(=O)N2CCOCC2)CCCCCC1C
InChIInChI=1S/C15H27NO2/c1-3-15(8-6-4-5-7-13(15)2)14(17)16-9-11-18-12-10-16/h13H,3-12H2,1-2H3
InChIKeyGXJPZYMADTZIGF-UHFFFAOYSA-N
XLogP2.84
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,1-diethyl-2-methylcycloheptane-1-carboxamide
CID 20549202
(1-hydroxycyclobutyl)-morpholin-4-ylmethanone
CID 130279279
(2-fluoro-1-methylcyclopropyl)-morpholin-4-ylmethanone
CID 130854846
N-(2,2-dimethylcyclohexyl)morpholine-4-carboxamide
CID 113255358
1-morpholin-4-yl-2-[1-(pyrrolidine-1-carbonyl)cyclopentyl]ethanone
CID 39964571
(1-morpholin-4-ylcyclohexyl)-(3-propoxypiperidin-1-yl)methanone
CID 131925385
(2-amino-1-methylcyclopentyl)-(1,4-oxazepan-4-yl)methanone
CID 82767352
1-(1-ethyl-2-methylcyclobutyl)ethanone
CID 59190029
(1-ethylpiperidin-2-yl)-morpholin-4-ylmethanone
CID 142202703
4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid
CID 63126334
1-(cyclobutylmethyl)-2-methylcyclohexane-1-carboxylic acid
CID 130935055
3-[(2,2-dimethylcyclohexyl)amino]-1-morpholin-4-ylpropan-1-one
CID 112700334

Frequently Asked Questions

What is the IUPAC name of (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone?
The IUPAC name of (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone (CID 20549212) is (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone?
The canonical SMILES for (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone is CCC1(C(=O)N2CCOCC2)CCCCCC1C.
What is the InChIKey of (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone?
The InChIKey is GXJPZYMADTZIGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-3-15(8-6-4-5-7-13(15)2)14(17)16-9-11-18-12-10-16/h13H,3-12H2,1-2H3.
What are the key properties of (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone?
(1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone has a molecular weight of 253.39 g/mol, XLogP of 2.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethyl-2-methylcycloheptyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 20549212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).