1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine

C16H26N2O — CID 62633818

IUPAC1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine
SMILESCCC(NCC1CC2CCC(C1)N2C)c1ccco1
InChIInChI=1S/C16H26N2O/c1-3-15(16-5-4-8-19-16)17-11-12-9-13-6-7-14(10-12)18(13)2/h4-5,8,12-15,17H,3,6-7,9-11H2,1-2H3
InChIKeyOVUNLWYUEVMALF-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.19
Rot. Bonds5

About 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine

1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine (PubChem CID 62633818) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine
PubChem CID62633818
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine
SMILESCCC(NCC1CC2CCC(C1)N2C)c1ccco1
InChIInChI=1S/C16H26N2O/c1-3-15(16-5-4-8-19-16)17-11-12-9-13-6-7-14(10-12)18(13)2/h4-5,8,12-15,17H,3,6-7,9-11H2,1-2H3
InChIKeyOVUNLWYUEVMALF-UHFFFAOYSA-N
XLogP3.19
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine with MolForge

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Related Compounds

N-(cyclohexylmethyl)-1-(furan-2-yl)propan-1-amine
CID 62633963
N-(2-cyclopentylethyl)-1-(furan-2-yl)propan-1-amine
CID 62633625
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-1-(5-methylfuran-2-yl)ethanamine
CID 54898654
2-methoxy-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-1-phenylethanamine
CID 103464090
N-(cyclopropylmethyl)-1-(furan-2-yl)-2-(2-methylpropoxy)ethanamine
CID 119110601
N'-[1-(furan-2-yl)propyl]ethane-1,2-diamine
CID 62633441
N-(1-cyclopropylethyl)-1-(furan-2-yl)propan-1-amine
CID 62632332
8-[1-(furan-2-yl)propyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 62632203
(1R)-1-(furan-2-yl)-N-[(1-methylpiperidin-4-yl)methyl]ethanamine
CID 81403301
N-[(1,4-dimethylpiperidin-4-yl)methyl]-1-(furan-2-yl)propan-1-amine
CID 107163253
1-(5-ethylthiophen-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]ethanamine
CID 61335739
N-[1-(furan-2-yl)propyl]-3,5-dimethylcyclohexan-1-amine
CID 64731661

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine?
The IUPAC name of 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine (CID 62633818) is 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine.
What is the SMILES notation for 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine?
The canonical SMILES for 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine is CCC(NCC1CC2CCC(C1)N2C)c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine?
The InChIKey is OVUNLWYUEVMALF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-15(16-5-4-8-19-16)17-11-12-9-13-6-7-14(10-12)18(13)2/h4-5,8,12-15,17H,3,6-7,9-11H2,1-2H3.
What are the key properties of 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine?
1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine has a molecular weight of 262.40 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]propan-1-amine is sourced from PubChem (CID 62633818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).