2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine

C18H30N2O — CID 62611413

IUPAC2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(N)C(CN(Cc2ccco2)C2CC2)C1
InChIInChI=1S/C18H30N2O/c1-2-4-14-6-9-18(19)15(11-14)12-20(16-7-8-16)13-17-5-3-10-21-17/h3,5,10,14-16,18H,2,4,6-9,11-13,19H2,1H3
InChIKeyYOQXYXOBULBSHL-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.79
Rot. Bonds7

About 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine

2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine (PubChem CID 62611413) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine
PubChem CID62611413
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(N)C(CN(Cc2ccco2)C2CC2)C1
InChIInChI=1S/C18H30N2O/c1-2-4-14-6-9-18(19)15(11-14)12-20(16-7-8-16)13-17-5-3-10-21-17/h3,5,10,14-16,18H,2,4,6-9,11-13,19H2,1H3
InChIKeyYOQXYXOBULBSHL-UHFFFAOYSA-N
XLogP3.79
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine with MolForge

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Related Compounds

2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-one
CID 62612741
2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propylcyclohexan-1-ol
CID 62608837
2-[[cyclopropyl(propyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 55093550
2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-methylcyclohexan-1-amine
CID 62616432
2-[[cyclopropyl(2-methoxyethyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 62608938
5-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79855711
N-[2-(azetidin-3-yl)ethyl]-N-(furan-2-ylmethyl)cyclopropanamine
CID 116679776
2-[(2-amino-5-propylcyclohexyl)methyl-cyclohexylamino]ethanol
CID 62608943
2-[[methyl-(2-methylcyclohexyl)amino]methyl]-4-propylcyclohexan-1-amine
CID 63493740
N-(furan-2-ylmethyl)-N-(2-methoxyethyl)cyclopropanamine
CID 47023472
N-(furan-2-ylmethyl)-N-[[(2R)-pyrrolidin-2-yl]methyl]cyclopropanamine
CID 102819455
4-[[4-[(4-fluorophenyl)methyl-(furan-2-ylmethyl)amino]cyclohexyl]methyl]cyclohexan-1-amine
CID 23821498

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine?
The IUPAC name of 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine (CID 62611413) is 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine.
What is the SMILES notation for 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine?
The canonical SMILES for 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine is CCCC1CCC(N)C(CN(Cc2ccco2)C2CC2)C1.
What is the InChIKey of 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine?
The InChIKey is YOQXYXOBULBSHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-2-4-14-6-9-18(19)15(11-14)12-20(16-7-8-16)13-17-5-3-10-21-17/h3,5,10,14-16,18H,2,4,6-9,11-13,19H2,1H3.
What are the key properties of 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine?
2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine has a molecular weight of 290.45 g/mol, XLogP of 3.79, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-amine is sourced from PubChem (CID 62611413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).