2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine

C14H23NO — CID 115651167

IUPAC2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine
SMILESCc1ccoc1CNC1CCCC(C)C1C
InChIInChI=1S/C14H23NO/c1-10-5-4-6-13(12(10)3)15-9-14-11(2)7-8-16-14/h7-8,10,12-13,15H,4-6,9H2,1-3H3
InChIKeyRXCYPZZXTTWTIF-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.50
Rot. Bonds3

About 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine

2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine (PubChem CID 115651167) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine
PubChem CID115651167
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine
SMILESCc1ccoc1CNC1CCCC(C)C1C
InChIInChI=1S/C14H23NO/c1-10-5-4-6-13(12(10)3)15-9-14-11(2)7-8-16-14/h7-8,10,12-13,15H,4-6,9H2,1-3H3
InChIKeyRXCYPZZXTTWTIF-UHFFFAOYSA-N
XLogP3.50
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(3-methylfuran-2-yl)methylamino]cyclohexyl]methanol
CID 111467057
N-[(3-methylfuran-2-yl)methyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 115652214
(1S,2S,3R)-2,3-dimethyl-N-[(4-methylphenyl)methyl]cyclohexan-1-amine
CID 11923056
(1S,2S,3R)-2,3-dimethyl-N-[(3-methylthiophen-2-yl)methyl]cyclohexan-1-amine
CID 11923130
(1R,2R,3S)-2,3-dimethyl-N-[(3-methylthiophen-2-yl)methyl]cyclohexan-1-amine
CID 7839003
(1R,2S,3R)-2,3-dimethyl-N-[(3-methylthiophen-2-yl)methyl]cyclohexan-1-amine
CID 11923126
2-[[(2,3-dimethylcyclopentyl)amino]methyl]furan-3-carboxylic acid
CID 103254759
(1R,2R,3R)-N-[(4-fluorophenyl)methyl]-2,3-dimethylcyclohexan-1-amine
CID 11920641
2,2-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine
CID 115693333
2,3-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 43663217
2-[[(2,3-dimethylcyclohexyl)amino]methyl]aniline
CID 66386630
methylcyclopropane;(3-methylfuran-2-yl)methanamine
CID 142883661

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine (CID 115651167) is 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine is Cc1ccoc1CNC1CCCC(C)C1C.
What is the InChIKey of 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine?
The InChIKey is RXCYPZZXTTWTIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-10-5-4-6-13(12(10)3)15-9-14-11(2)7-8-16-14/h7-8,10,12-13,15H,4-6,9H2,1-3H3.
What are the key properties of 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine?
2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine has a molecular weight of 221.34 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[(3-methylfuran-2-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 115651167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).