2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine

C16H27NO — CID 83175553

IUPAC2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
SMILESCCCC1CCC(C(Cc2ccoc2)NC)CC1
InChIInChI=1S/C16H27NO/c1-3-4-13-5-7-15(8-6-13)16(17-2)11-14-9-10-18-12-14/h9-10,12-13,15-17H,3-8,11H2,1-2H3
InChIKeyQNKIXTNQUJVWKZ-UHFFFAOYSA-N
MW249.40 g/mol
LogP4.02
Rot. Bonds6

About 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine

2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine (PubChem CID 83175553) has the molecular formula C16H27NO and a molecular weight of 249.40 g/mol. Its IUPAC name is 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine.

Molecular Properties

Compound Name2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
PubChem CID83175553
Molecular FormulaC16H27NO
Molecular Weight249.40 g/mol
Exact Mass249.21
IUPAC Name2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
SMILESCCCC1CCC(C(Cc2ccoc2)NC)CC1
InChIInChI=1S/C16H27NO/c1-3-4-13-5-7-15(8-6-13)16(17-2)11-14-9-10-18-12-14/h9-10,12-13,15-17H,3-8,11H2,1-2H3
InChIKeyQNKIXTNQUJVWKZ-UHFFFAOYSA-N
XLogP4.02
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclobutyl-2-(furan-3-yl)-N-methylethanamine
CID 83175338
2-(4-bromophenyl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 65425315
1-(4,4-dimethylcyclohexyl)-2-(furan-3-yl)-N-methylethanamine
CID 83174667
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine
CID 105030037
2-(3,4-dichlorophenyl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 65424347
2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 65425118
[1-cyclopropyl-2-(furan-3-yl)ethyl]hydrazine
CID 105202437
2-(3-bromo-4-fluorophenyl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 65424348
N-methyl-1-(4-propylcyclohexyl)butan-1-amine
CID 65423384
1-(4-tert-butylcyclohexyl)-N-ethyl-2-(furan-3-yl)ethanamine
CID 83175651
N-ethyl-1-(3-ethylcyclopentyl)-2-(furan-3-yl)ethanamine
CID 83175352
2-(furan-3-yl)-N-methyl-1-(5-methyloxolan-3-yl)ethanamine
CID 105030244

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine?
The IUPAC name of 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine (CID 83175553) is 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine.
What is the SMILES notation for 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine?
The canonical SMILES for 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine is CCCC1CCC(C(Cc2ccoc2)NC)CC1.
What is the InChIKey of 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine?
The InChIKey is QNKIXTNQUJVWKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO/c1-3-4-13-5-7-15(8-6-13)16(17-2)11-14-9-10-18-12-14/h9-10,12-13,15-17H,3-8,11H2,1-2H3.
What are the key properties of 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine?
2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine has a molecular weight of 249.40 g/mol, XLogP of 4.02, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine is sourced from PubChem (CID 83175553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).