N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine

C16H25NO — CID 114817252

IUPACN-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine
SMILESCC(NC1CCC2(CCCC2)CC1)c1ccco1
InChIInChI=1S/C16H25NO/c1-13(15-5-4-12-18-15)17-14-6-10-16(11-7-14)8-2-3-9-16/h4-5,12-14,17H,2-3,6-11H2,1H3
InChIKeyZKLZJHXTJABJFC-UHFFFAOYSA-N
MW247.38 g/mol
LogP4.43
Rot. Bonds3

About N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine

N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine (PubChem CID 114817252) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine
PubChem CID114817252
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC NameN-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine
SMILESCC(NC1CCC2(CCCC2)CC1)c1ccco1
InChIInChI=1S/C16H25NO/c1-13(15-5-4-12-18-15)17-14-6-10-16(11-7-14)8-2-3-9-16/h4-5,12-14,17H,2-3,6-11H2,1H3
InChIKeyZKLZJHXTJABJFC-UHFFFAOYSA-N
XLogP4.43
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(furan-2-yl)ethyl]-1-oxaspiro[5.5]undecan-4-amine
CID 79894899
N-[(1S)-1-(furan-2-yl)ethyl]-1-methylpiperidin-4-amine
CID 81403796
N-[(1S)-1-(furan-2-yl)ethyl]azepan-4-amine
CID 103982613
N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine
CID 81403066
N-[1-(furan-2-yl)ethyl]-1-methylazepan-4-amine
CID 65070258
N-[(1S)-1-(furan-2-yl)ethyl]-5-oxaspiro[3.5]nonan-8-amine
CID 81399877
N-[1-(furan-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 43730440
N-[(1S)-1-(furan-2-yl)ethyl]oxan-3-amine
CID 81402561
N-[(1S)-1-(furan-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 81402923
N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine
CID 81403874
N-[1-(2-chlorophenyl)ethyl]spiro[4.5]decan-8-amine
CID 114817141
N-[(1R)-1-(furan-2-yl)ethyl]-1,1-dioxothiolan-3-amine
CID 81402788

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine?
The IUPAC name of N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine (CID 114817252) is N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine is CC(NC1CCC2(CCCC2)CC1)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine?
The InChIKey is ZKLZJHXTJABJFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-13(15-5-4-12-18-15)17-14-6-10-16(11-7-14)8-2-3-9-16/h4-5,12-14,17H,2-3,6-11H2,1H3.
What are the key properties of N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine?
N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine has a molecular weight of 247.38 g/mol, XLogP of 4.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine is sourced from PubChem (CID 114817252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).