N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide

C18H27NO3 — CID 138995548

IUPACN-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide
SMILESCC(C)c1ccoc1C(=O)NCC1CCC2(CCCCC2)O1
InChIInChI=1S/C18H27NO3/c1-13(2)15-7-11-21-16(15)17(20)19-12-14-6-10-18(22-14)8-4-3-5-9-18/h7,11,13-14H,3-6,8-10,12H2,1-2H3,(H,19,20)
InChIKeyZPULUFLEVVMLAK-UHFFFAOYSA-N
MW305.42 g/mol
LogP4.01
Rot. Bonds4

About N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide

N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide (PubChem CID 138995548) has the molecular formula C18H27NO3 and a molecular weight of 305.42 g/mol. Its IUPAC name is N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide
PubChem CID138995548
Molecular FormulaC18H27NO3
Molecular Weight305.42 g/mol
Exact Mass305.20
IUPAC NameN-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide
SMILESCC(C)c1ccoc1C(=O)NCC1CCC2(CCCCC2)O1
InChIInChI=1S/C18H27NO3/c1-13(2)15-7-11-21-16(15)17(20)19-12-14-6-10-18(22-14)8-4-3-5-9-18/h7,11,13-14H,3-6,8-10,12H2,1-2H3,(H,19,20)
InChIKeyZPULUFLEVVMLAK-UHFFFAOYSA-N
XLogP4.01
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-methylphenyl)sulfamoyl]-N-(1-oxaspiro[4.5]decan-2-ylmethyl)benzamide
CID 139008315
2-(1-oxaspiro[4.4]nonan-2-ylmethylamino)-N-propan-2-ylacetamide
CID 102896860
N-(2-methylpropyl)-3-(1-oxaspiro[4.5]decan-2-ylmethylamino)propanamide
CID 102897768
2-chloro-N-(1-oxaspiro[4.5]decan-2-ylmethyl)propan-1-amine
CID 102900792
N-[[8-(2-phenylethyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]furan-2-carboxamide
CID 118755620
N-[2-[(4-chlorobenzoyl)amino]ethyl]-3-propan-2-ylfuran-2-carboxamide
CID 119052204
N-[[(2S)-1-oxaspiro[4.5]decan-2-yl]methyl]-3-(2-oxo-1,3-oxazolidin-3-yl)benzamide
CID 99795460
1-bromo-N-(1-oxaspiro[4.5]decan-2-ylmethyl)propan-2-amine
CID 107859550
N-(1-oxaspiro[4.5]decan-2-ylmethyl)-5-pyridin-4-yl-1H-pyrazole-4-carboxamide
CID 86819624
2-methyl-2-(1-oxaspiro[4.5]decan-2-ylmethylcarbamoylamino)propanoic acid
CID 102896511
2-methyl-3-(1-oxaspiro[4.4]nonan-2-yl)-1-phenylpropan-1-one
CID 102898959
methyl 2-chloro-3-(1-oxaspiro[4.5]decan-2-ylmethylamino)propanoate
CID 103491800

Frequently Asked Questions

What is the IUPAC name of N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide?
The IUPAC name of N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide (CID 138995548) is N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide.
What is the SMILES notation for N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide?
The canonical SMILES for N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide is CC(C)c1ccoc1C(=O)NCC1CCC2(CCCCC2)O1.
What is the InChIKey of N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide?
The InChIKey is ZPULUFLEVVMLAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO3/c1-13(2)15-7-11-21-16(15)17(20)19-12-14-6-10-18(22-14)8-4-3-5-9-18/h7,11,13-14H,3-6,8-10,12H2,1-2H3,(H,19,20).
What are the key properties of N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide?
N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide has a molecular weight of 305.42 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-oxaspiro[4.5]decan-2-ylmethyl)-3-propan-2-ylfuran-2-carboxamide is sourced from PubChem (CID 138995548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).