2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine

C14H24N2O — CID 61421776

IUPAC2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine
SMILESCC1CCC(CN)C(N(C)Cc2ccoc2)C1
InChIInChI=1S/C14H24N2O/c1-11-3-4-13(8-15)14(7-11)16(2)9-12-5-6-17-10-12/h5-6,10-11,13-14H,3-4,7-9,15H2,1-2H3
InChIKeyAMYOAGGGHXHMCI-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.47
Rot. Bonds4

About 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine

2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine (PubChem CID 61421776) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine
PubChem CID61421776
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine
SMILESCC1CCC(CN)C(N(C)Cc2ccoc2)C1
InChIInChI=1S/C14H24N2O/c1-11-3-4-13(8-15)14(7-11)16(2)9-12-5-6-17-10-12/h5-6,10-11,13-14H,3-4,7-9,15H2,1-2H3
InChIKeyAMYOAGGGHXHMCI-UHFFFAOYSA-N
XLogP2.47
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-5-tert-butyl-N-(furan-3-ylmethyl)-N-methylcyclohexan-1-amine
CID 61421823
2-(aminomethyl)-N-(furan-3-ylmethyl)-N-methylcycloheptan-1-amine
CID 61421775
2-N-(furan-3-ylmethyl)-2-N-methylcyclohexane-1,2-diamine
CID 61422604
2-(aminomethyl)-N,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]cyclohexan-1-amine
CID 63013726
2-(aminomethyl)-N,5-dimethyl-N-propylcyclohexan-1-amine
CID 43293723
2-(furan-3-ylmethyl)-4-methylcyclohexan-1-amine
CID 83172878
2-[[2-(aminomethyl)-5-methylcyclohexyl]-methylamino]-N,N-dimethylacetamide
CID 43374685
4-N-(furan-3-ylmethyl)-4-N-methylcyclohexane-1,4-diamine
CID 62807618
4-[furan-3-ylmethyl(methyl)amino]pyrrolidin-3-ol
CID 63702901
2-(aminomethyl)-N-[(4-chlorophenyl)methyl]-N-methylcyclobutan-1-amine
CID 80996130
2-[furan-3-ylmethyl(methyl)amino]cycloheptane-1-carbonitrile
CID 61422186
1-cyclopentyl-N-(furan-3-ylmethyl)-N-methylethane-1,2-diamine
CID 62071760

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine (CID 61421776) is 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine is CC1CCC(CN)C(N(C)Cc2ccoc2)C1.
What is the InChIKey of 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine?
The InChIKey is AMYOAGGGHXHMCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-11-3-4-13(8-15)14(7-11)16(2)9-12-5-6-17-10-12/h5-6,10-11,13-14H,3-4,7-9,15H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine?
2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine has a molecular weight of 236.36 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(furan-3-ylmethyl)-N,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 61421776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).