N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine

C18H25NO — CID 105139753

IUPACN-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine
SMILESCCNC(CCCc1ccccc1)CCc1ccco1
InChIInChI=1S/C18H25NO/c1-2-19-17(13-14-18-12-7-15-20-18)11-6-10-16-8-4-3-5-9-16/h3-5,7-9,12,15,17,19H,2,6,10-11,13-14H2,1H3
InChIKeyLHZMUEGIGLCUKQ-UHFFFAOYSA-N
MW271.40 g/mol
LogP4.21
Rot. Bonds9

About N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine

N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine (PubChem CID 105139753) has the molecular formula C18H25NO and a molecular weight of 271.40 g/mol. Its IUPAC name is N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine.

Molecular Properties

Compound NameN-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine
PubChem CID105139753
Molecular FormulaC18H25NO
Molecular Weight271.40 g/mol
Exact Mass271.19
IUPAC NameN-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine
SMILESCCNC(CCCc1ccccc1)CCc1ccco1
InChIInChI=1S/C18H25NO/c1-2-19-17(13-14-18-12-7-15-20-18)11-6-10-16-8-4-3-5-9-16/h3-5,7-9,12,15,17,19H,2,6,10-11,13-14H2,1H3
InChIKeyLHZMUEGIGLCUKQ-UHFFFAOYSA-N
XLogP4.21
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-4-(furan-2-yl)-1-phenylbutan-2-amine
CID 61064729
N-ethyl-6-ethylsulfonyl-1-(furan-2-yl)hexan-3-amine
CID 105152508
1-ethoxy-N-ethyl-7-phenylheptan-4-amine
CID 105139776
1-(furan-2-yl)-N-propyldodecan-3-amine
CID 105124522
N-ethyl-8,8,8-trifluoro-1-phenyloctan-4-amine
CID 105174493
1-N,1-N,3-N-triethyl-6-phenylhexane-1,3-diamine
CID 79086954
1-cyclopentyl-N-ethyl-4-(furan-2-yl)butan-2-amine
CID 105138868
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-ethyl-4-(furan-2-yl)butan-2-amine
CID 105162710
1-(4-bromophenyl)-N-ethyl-5-phenylpentan-2-amine
CID 63412898
N-ethyl-4-(furan-2-yl)-1-(2-nitrophenyl)butan-2-amine
CID 61065495
1-(1-benzothiophen-3-yl)-N-ethyl-4-(furan-2-yl)butan-2-amine
CID 105116408
N-ethyl-1-(1-methylimidazol-2-yl)-5-phenylpentan-2-amine
CID 105167284

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine?
The IUPAC name of N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine (CID 105139753) is N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine.
What is the SMILES notation for N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine?
The canonical SMILES for N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine is CCNC(CCCc1ccccc1)CCc1ccco1.
What is the InChIKey of N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine?
The InChIKey is LHZMUEGIGLCUKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO/c1-2-19-17(13-14-18-12-7-15-20-18)11-6-10-16-8-4-3-5-9-16/h3-5,7-9,12,15,17,19H,2,6,10-11,13-14H2,1H3.
What are the key properties of N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine?
N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine has a molecular weight of 271.40 g/mol, XLogP of 4.21, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(furan-2-yl)-6-phenylhexan-3-amine is sourced from PubChem (CID 105139753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).