(1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol

C15H25NO2 — CID 70048188

IUPAC(1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol
SMILESCCC(C1CCCCC1)[C@H](N)[C@@H](O)c1ccco1
InChIInChI=1S/C15H25NO2/c1-2-12(11-7-4-3-5-8-11)14(16)15(17)13-9-6-10-18-13/h6,9-12,14-15,17H,2-5,7-8,16H2,1H3/t12?,14-,15-/m0/s1
InChIKeyWRMWWPXAFNINJC-ZRNAQANOSA-N
MW251.37 g/mol
LogP3.25
Rot. Bonds5

About (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol

(1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol (PubChem CID 70048188) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol.

Molecular Properties

Compound Name(1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol
PubChem CID70048188
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name(1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol
SMILESCCC(C1CCCCC1)[C@H](N)[C@@H](O)c1ccco1
InChIInChI=1S/C15H25NO2/c1-2-12(11-7-4-3-5-8-11)14(16)15(17)13-9-6-10-18-13/h6,9-12,14-15,17H,2-5,7-8,16H2,1H3/t12?,14-,15-/m0/s1
InChIKeyWRMWWPXAFNINJC-ZRNAQANOSA-N
XLogP3.25
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Launch Full Analysis

Related Compounds

2-amino-3-cyclohexyl-1-(furan-2-yl)propan-1-ol
CID 19378615
2-(1-cyclohexylpropylamino)-1-(furan-2-yl)ethanol
CID 62406474
2-amino-3-cyclohexyl-3-(furan-2-yl)propan-1-ol
CID 70050486
N-(1-cyclohexylethyl)-1-(furan-2-yl)propan-1-amine
CID 62631853
2-[[(1R)-1-cyclohexylethyl]amino]-1-(furan-2-yl)ethanol
CID 81384880
cyclobutyl(furan-2-yl)methanamine;hydrochloride
CID 86263195
(2-ethylcyclohexyl)-(furan-2-yl)methanol
CID 63861285
1-cyclopentylsulfanyl-1-(furan-2-yl)butan-2-amine
CID 63115035
tert-butyl N-[(2S)-1-[[(2S)-1-[[(1S,2R)-3-cyclohexyl-1-(furan-2-yl)-1-hydroxypentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
CID 70046108
1-(cyclopentylmethoxy)-1-(furan-2-yl)butan-2-amine
CID 66324500
N-(cyclohexylmethyl)-1-(furan-2-yl)propan-1-amine
CID 62633963
(S)-cyclopropyl(furan-2-yl)methanol
CID 39235067

Frequently Asked Questions

What is the IUPAC name of (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol?
The IUPAC name of (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol (CID 70048188) is (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol.
What is the SMILES notation for (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol?
The canonical SMILES for (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol is CCC(C1CCCCC1)[C@H](N)[C@@H](O)c1ccco1.
What is the InChIKey of (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol?
The InChIKey is WRMWWPXAFNINJC-ZRNAQANOSA-N. The full InChI is InChI=1S/C15H25NO2/c1-2-12(11-7-4-3-5-8-11)14(16)15(17)13-9-6-10-18-13/h6,9-12,14-15,17H,2-5,7-8,16H2,1H3/t12?,14-,15-/m0/s1.
What are the key properties of (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol?
(1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol has a molecular weight of 251.37 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S)-2-amino-3-cyclohexyl-1-(furan-2-yl)pentan-1-ol is sourced from PubChem (CID 70048188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).