N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide

C16H30N2O2 — CID 82949166

IUPACN-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
SMILESCOCCN(C(=O)C1CCC2CCCCC2N1)C(C)C
InChIInChI=1S/C16H30N2O2/c1-12(2)18(10-11-20-3)16(19)15-9-8-13-6-4-5-7-14(13)17-15/h12-15,17H,4-11H2,1-3H3
InChIKeyOYPOTVAUTGHLBS-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.18
Rot. Bonds5

About N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide

N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide (PubChem CID 82949166) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
PubChem CID82949166
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC NameN-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
SMILESCOCCN(C(=O)C1CCC2CCCCC2N1)C(C)C
InChIInChI=1S/C16H30N2O2/c1-12(2)18(10-11-20-3)16(19)15-9-8-13-6-4-5-7-14(13)17-15/h12-15,17H,4-11H2,1-3H3
InChIKeyOYPOTVAUTGHLBS-UHFFFAOYSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxyethyl)-N-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 82949267
N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
CID 66469565
N-(2-methoxyethyl)-N-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;hydrochloride
CID 119280509
N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-N-(2-methoxyethyl)propan-2-amine
CID 82950918
N-(2-methoxyethyl)-N-(3-methoxypropyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 60980755
N-ethyl-N-(2-methoxyethyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 54949278
2-[2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl(2-methoxyethyl)amino]acetic acid
CID 79270937
4-hydroxy-N-(2-methoxyethyl)-N-propan-2-ylpyrrolidine-2-carboxamide
CID 82948394
N-(2-methoxyethyl)-5-methyl-N-propan-2-ylpiperazine-2-carboxamide
CID 82950818
5-[2-methoxyethyl(propan-2-yl)carbamoyl]oxolane-2-carboxylic acid
CID 102688859
1-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-yl)-3-methylpentan-1-one
CID 116585964
N-(2-hydroxy-3-methoxypropyl)-N-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 54999254

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide (CID 82949166) is N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide is COCCN(C(=O)C1CCC2CCCCC2N1)C(C)C.
What is the InChIKey of N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide?
The InChIKey is OYPOTVAUTGHLBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-12(2)18(10-11-20-3)16(19)15-9-8-13-6-4-5-7-14(13)17-15/h12-15,17H,4-11H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide?
N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide has a molecular weight of 282.43 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide is sourced from PubChem (CID 82949166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).