[2-(furan-3-yl)-4-propylcyclohexyl]methanamine

C14H23NO — CID 81012027

IUPAC[2-(furan-3-yl)-4-propylcyclohexyl]methanamine
SMILESCCCC1CCC(CN)C(c2ccoc2)C1
InChIInChI=1S/C14H23NO/c1-2-3-11-4-5-12(9-15)14(8-11)13-6-7-16-10-13/h6-7,10-12,14H,2-5,8-9,15H2,1H3
InChIKeySIEIHTFIMXRKDV-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.54
Rot. Bonds4

About [2-(furan-3-yl)-4-propylcyclohexyl]methanamine

[2-(furan-3-yl)-4-propylcyclohexyl]methanamine (PubChem CID 81012027) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is [2-(furan-3-yl)-4-propylcyclohexyl]methanamine.

Molecular Properties

Compound Name[2-(furan-3-yl)-4-propylcyclohexyl]methanamine
PubChem CID81012027
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name[2-(furan-3-yl)-4-propylcyclohexyl]methanamine
SMILESCCCC1CCC(CN)C(c2ccoc2)C1
InChIInChI=1S/C14H23NO/c1-2-3-11-4-5-12(9-15)14(8-11)13-6-7-16-10-13/h6-7,10-12,14H,2-5,8-9,15H2,1H3
InChIKeySIEIHTFIMXRKDV-UHFFFAOYSA-N
XLogP3.54
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(furan-3-yl)-4-propylcyclohexyl]methyl]propan-2-amine
CID 81029613
N-[[2-(furan-3-yl)-4-propylcyclohexyl]methyl]propan-1-amine
CID 81029610
[2-(4-fluorophenyl)-4-propylcyclohexyl]methanamine
CID 81012117
[2-(2,3-dihydro-1-benzofuran-5-yl)-4-propylcyclohexyl]methanamine
CID 104545172
[2-(2,6-difluoro-3-methylphenyl)-4-propylcyclohexyl]methanamine
CID 82828508
(4-propyl-2-quinolin-6-ylcyclohexyl)methanamine
CID 81228190
[2-(3-bromo-2,6-difluorophenyl)-4-propylcyclohexyl]methanamine
CID 106943871
1-[4-tert-butyl-2-(furan-3-yl)cyclohexyl]-N-methylmethanamine
CID 81030983
2-(aminomethyl)-5-propylcyclohexan-1-amine
CID 62070306
[2-(5-fluoro-1-benzofuran-2-yl)-4-propylcyclohexyl]methanamine
CID 114735548
N-[[2-(furan-3-yl)cyclopropyl]methyl]propan-1-amine
CID 63208002
2-[(1R,2R)-2-(furan-3-yl)cyclopropyl]ethanol
CID 122211518

Frequently Asked Questions

What is the IUPAC name of [2-(furan-3-yl)-4-propylcyclohexyl]methanamine?
The IUPAC name of [2-(furan-3-yl)-4-propylcyclohexyl]methanamine (CID 81012027) is [2-(furan-3-yl)-4-propylcyclohexyl]methanamine.
What is the SMILES notation for [2-(furan-3-yl)-4-propylcyclohexyl]methanamine?
The canonical SMILES for [2-(furan-3-yl)-4-propylcyclohexyl]methanamine is CCCC1CCC(CN)C(c2ccoc2)C1.
What is the InChIKey of [2-(furan-3-yl)-4-propylcyclohexyl]methanamine?
The InChIKey is SIEIHTFIMXRKDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-2-3-11-4-5-12(9-15)14(8-11)13-6-7-16-10-13/h6-7,10-12,14H,2-5,8-9,15H2,1H3.
What are the key properties of [2-(furan-3-yl)-4-propylcyclohexyl]methanamine?
[2-(furan-3-yl)-4-propylcyclohexyl]methanamine has a molecular weight of 221.34 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(furan-3-yl)-4-propylcyclohexyl]methanamine is sourced from PubChem (CID 81012027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).