(1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol

C14H24N2O2 — CID 97053749

IUPAC(1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol
SMILESCCCN1CCC(NC[C@H](O)c2ccco2)CC1
InChIInChI=1S/C14H24N2O2/c1-2-7-16-8-5-12(6-9-16)15-11-13(17)14-4-3-10-18-14/h3-4,10,12-13,15,17H,2,5-9,11H2,1H3/t13-/m0/s1
InChIKeyNFQWMNJWUHTNDK-ZDUSSCGKSA-N
MW252.36 g/mol
LogP1.78
Rot. Bonds6

About (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol

(1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol (PubChem CID 97053749) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name(1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol
PubChem CID97053749
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name(1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol
SMILESCCCN1CCC(NC[C@H](O)c2ccco2)CC1
InChIInChI=1S/C14H24N2O2/c1-2-7-16-8-5-12(6-9-16)15-11-13(17)14-4-3-10-18-14/h3-4,10,12-13,15,17H,2,5-9,11H2,1H3/t13-/m0/s1
InChIKeyNFQWMNJWUHTNDK-ZDUSSCGKSA-N
XLogP1.78
TPSA48.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol with MolForge

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Related Compounds

1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
CID 60910521
N-[(1R)-1-(furan-2-yl)ethyl]-1-(1-propylpiperidin-4-yl)ethanamine
CID 81403845
1-ethyl-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]piperidin-4-amine
CID 43181238
1-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-methyl-3-(1-propylpiperidin-4-yl)guanidine
CID 111016865
(1R)-1-(furan-2-yl)-2-[[(3S)-thian-3-yl]amino]ethanol
CID 99717414
4-methyl-1-[(1-propylpiperidin-4-yl)amino]pentan-2-ol
CID 103779663
2-[(2,2-dimethylcyclopropyl)amino]-1-(furan-2-yl)ethanol
CID 61223910
1-ethyl-2-[2-(furan-2-yl)-2-hydroxyethyl]-3-[1-(2-methoxyethyl)piperidin-4-yl]guanidine
CID 111991887
N-(3,3-diphenylpropyl)-1-propylpiperidin-4-amine
CID 2846321
2-(1-cyclohexylpropylamino)-1-(furan-2-yl)ethanol
CID 62406474
2-[(2,3-dimethylcyclohexyl)amino]-1-(furan-2-yl)ethanol
CID 55025032
1-ethyl-2-[2-(furan-2-yl)-2-hydroxyethyl]-3-[1-(3-methoxypropyl)piperidin-4-yl]guanidine;hydroiodide
CID 111993538

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol?
The IUPAC name of (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol (CID 97053749) is (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol.
What is the SMILES notation for (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol?
The canonical SMILES for (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol is CCCN1CCC(NC[C@H](O)c2ccco2)CC1.
What is the InChIKey of (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol?
The InChIKey is NFQWMNJWUHTNDK-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-2-7-16-8-5-12(6-9-16)15-11-13(17)14-4-3-10-18-14/h3-4,10,12-13,15,17H,2,5-9,11H2,1H3/t13-/m0/s1.
What are the key properties of (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol?
(1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol has a molecular weight of 252.36 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(furan-2-yl)-2-[(1-propylpiperidin-4-yl)amino]ethanol is sourced from PubChem (CID 97053749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).