N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine

C15H25NO — CID 81403874

IUPACN-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(N[C@H](C)c2ccco2)CC1
InChIInChI=1S/C15H25NO/c1-3-5-13-7-9-14(10-8-13)16-12(2)15-6-4-11-17-15/h4,6,11-14,16H,3,5,7-10H2,1-2H3/t12-,13?,14?/m1/s1
InChIKeyKKTXMFLFMFTQBQ-IYXRBSQSSA-N
MW235.37 g/mol
LogP4.29
Rot. Bonds5

About N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine

N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine (PubChem CID 81403874) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine
PubChem CID81403874
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC NameN-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(N[C@H](C)c2ccco2)CC1
InChIInChI=1S/C15H25NO/c1-3-5-13-7-9-14(10-8-13)16-12(2)15-6-4-11-17-15/h4,6,11-14,16H,3,5,7-10H2,1-2H3/t12-,13?,14?/m1/s1
InChIKeyKKTXMFLFMFTQBQ-IYXRBSQSSA-N
XLogP4.29
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(furan-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 43730440
N-[(1S)-1-(furan-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 81402923
2-[1-[(4-propylcyclohexyl)amino]ethyl]benzene-1,3-diol
CID 107710869
N-[(1S)-1-(furan-2-yl)ethyl]-1-methylpiperidin-4-amine
CID 81403796
N-[(1S)-1-(furan-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 81403823
N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine
CID 81403066
4-propyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine
CID 28655963
N-[(1R)-1-(2-chlorophenyl)ethyl]-4-propylcyclohexan-1-amine
CID 29040454
N-[1-(2-chlorophenyl)ethyl]-4-propylcyclohexan-1-amine
CID 43079434
N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine
CID 114817252
4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine
CID 63454289
N-[(1S)-1-(furan-2-yl)ethyl]azepan-4-amine
CID 103982613

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine?
The IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine (CID 81403874) is N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine.
What is the SMILES notation for N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine?
The canonical SMILES for N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine is CCCC1CCC(N[C@H](C)c2ccco2)CC1.
What is the InChIKey of N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine?
The InChIKey is KKTXMFLFMFTQBQ-IYXRBSQSSA-N. The full InChI is InChI=1S/C15H25NO/c1-3-5-13-7-9-14(10-8-13)16-12(2)15-6-4-11-17-15/h4,6,11-14,16H,3,5,7-10H2,1-2H3/t12-,13?,14?/m1/s1.
What are the key properties of N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine?
N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine has a molecular weight of 235.37 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine is sourced from PubChem (CID 81403874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).