2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine

C13H22N2O — CID 81403207

IUPAC2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine
SMILESC[C@@H](NC1CCCCC1CN)c1ccco1
InChIInChI=1S/C13H22N2O/c1-10(13-7-4-8-16-13)15-12-6-3-2-5-11(12)9-14/h4,7-8,10-12,15H,2-3,5-6,9,14H2,1H3/t10-,11?,12?/m1/s1
InChIKeyGAMGJRLKUVMGSE-VOMCLLRMSA-N
MW222.33 g/mol
LogP2.45
Rot. Bonds4

About 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine

2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine (PubChem CID 81403207) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine
PubChem CID81403207
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine
SMILESC[C@@H](NC1CCCCC1CN)c1ccco1
InChIInChI=1S/C13H22N2O/c1-10(13-7-4-8-16-13)15-12-6-3-2-5-11(12)9-14/h4,7-8,10-12,15H,2-3,5-6,9,14H2,1H3/t10-,11?,12?/m1/s1
InChIKeyGAMGJRLKUVMGSE-VOMCLLRMSA-N
XLogP2.45
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine
CID 81403374
2-[[(1S)-1-(furan-2-yl)ethyl]amino]cycloheptan-1-ol
CID 81399364
trans-(1S,2S)-2-[[(1S)-1-(furan-2-yl)ethyl]amino]cyclopentan-1-ol
CID 102733843
2-(aminomethyl)-N-[(1S)-1-(4-bromophenyl)ethyl]cyclohexan-1-amine
CID 81354238
N-[1-(furan-2-yl)ethyl]-2-methylsulfanylcyclopentan-1-amine
CID 103786666
2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine
CID 81402190
N-[(1R)-1-(furan-2-yl)ethyl]-2-methylsulfonylcyclopentan-1-amine
CID 81403412
N-[(1S)-1-(furan-2-yl)ethyl]-2-methyloxolan-3-amine
CID 82718277
(3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol
CID 131175689
2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine
CID 81364867
N-(2-cyclopentylethyl)-1-(furan-2-yl)ethanamine
CID 60919683
N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine
CID 81403066

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine (CID 81403207) is 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine is C[C@@H](NC1CCCCC1CN)c1ccco1.
What is the InChIKey of 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine?
The InChIKey is GAMGJRLKUVMGSE-VOMCLLRMSA-N. The full InChI is InChI=1S/C13H22N2O/c1-10(13-7-4-8-16-13)15-12-6-3-2-5-11(12)9-14/h4,7-8,10-12,15H,2-3,5-6,9,14H2,1H3/t10-,11?,12?/m1/s1.
What are the key properties of 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine?
2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine has a molecular weight of 222.33 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 81403207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).