N-[1-(furan-2-yl)ethyl]nonan-1-amine

C15H27NO — CID 43535684

IUPACN-[1-(furan-2-yl)ethyl]nonan-1-amine
SMILESCCCCCCCCCNC(C)c1ccco1
InChIInChI=1S/C15H27NO/c1-3-4-5-6-7-8-9-12-16-14(2)15-11-10-13-17-15/h10-11,13-14,16H,3-9,12H2,1-2H3
InChIKeyGSJLTGMOJIZCJD-UHFFFAOYSA-N
MW237.39 g/mol
LogP4.68
Rot. Bonds10

About N-[1-(furan-2-yl)ethyl]nonan-1-amine

N-[1-(furan-2-yl)ethyl]nonan-1-amine (PubChem CID 43535684) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]nonan-1-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]nonan-1-amine
PubChem CID43535684
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC NameN-[1-(furan-2-yl)ethyl]nonan-1-amine
SMILESCCCCCCCCCNC(C)c1ccco1
InChIInChI=1S/C15H27NO/c1-3-4-5-6-7-8-9-12-16-14(2)15-11-10-13-17-15/h10-11,13-14,16H,3-9,12H2,1-2H3
InChIKeyGSJLTGMOJIZCJD-UHFFFAOYSA-N
XLogP4.68
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(1R)-1-(furan-2-yl)ethyl]octan-1-amine
CID 81403081
3-[[(1R)-1-(furan-2-yl)ethyl]amino]propan-1-ol
CID 28714744
N'-[1-(furan-2-yl)ethyl]propane-1,3-diamine
CID 60889681
5-[1-(furan-2-yl)ethylamino]pentanenitrile
CID 60698105
N-[1-(furan-2-yl)ethyl]-4-phenylbutan-1-amine
CID 115708089
N'-butyl-N'-ethyl-N-[1-(furan-2-yl)ethyl]ethane-1,2-diamine
CID 62575573
4-[[(1S)-1-(furan-2-yl)ethyl]amino]butanenitrile
CID 81401126
N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine
CID 43205063
N-[1-(furan-2-yl)ethyl]-N'-methyl-N'-propylethane-1,2-diamine
CID 62560734
(1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine
CID 81399975
1-(furan-2-yl)-N-(2-pentan-2-yloxyethyl)ethanamine
CID 102987416
N-[(1R)-1-phenylethyl]heptan-1-amine
CID 14866487

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]nonan-1-amine?
The IUPAC name of N-[1-(furan-2-yl)ethyl]nonan-1-amine (CID 43535684) is N-[1-(furan-2-yl)ethyl]nonan-1-amine.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]nonan-1-amine?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]nonan-1-amine is CCCCCCCCCNC(C)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]nonan-1-amine?
The InChIKey is GSJLTGMOJIZCJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c1-3-4-5-6-7-8-9-12-16-14(2)15-11-10-13-17-15/h10-11,13-14,16H,3-9,12H2,1-2H3.
What are the key properties of N-[1-(furan-2-yl)ethyl]nonan-1-amine?
N-[1-(furan-2-yl)ethyl]nonan-1-amine has a molecular weight of 237.39 g/mol, XLogP of 4.68, 10 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]nonan-1-amine is sourced from PubChem (CID 43535684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).