1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol

C14H18N2O2 — CID 80525704

IUPAC1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol
SMILESNCC(c1ccncc1)C(O)CCc1ccco1
InChIInChI=1S/C14H18N2O2/c15-10-13(11-5-7-16-8-6-11)14(17)4-3-12-2-1-9-18-12/h1-2,5-9,13-14,17H,3-4,10,15H2
InChIKeyQSSDXDCOESORNG-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.71
Rot. Bonds6

About 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol

1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol (PubChem CID 80525704) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol.

Molecular Properties

Compound Name1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol
PubChem CID80525704
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol
SMILESNCC(c1ccncc1)C(O)CCc1ccco1
InChIInChI=1S/C14H18N2O2/c15-10-13(11-5-7-16-8-6-11)14(17)4-3-12-2-1-9-18-12/h1-2,5-9,13-14,17H,3-4,10,15H2
InChIKeyQSSDXDCOESORNG-UHFFFAOYSA-N
XLogP1.71
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-2-(2-chloro-4-fluorophenyl)-5-(furan-2-yl)pentan-3-ol
CID 65189777
N-[2-(furan-2-yl)ethyl]-1-pyridin-4-ylethanamine
CID 43515507
3-amino-1-phenyl-2-pyridin-4-ylpropan-1-ol
CID 80525677
1-(3-fluoro-4-pyridinyl)-3-(furan-2-yl)propan-1-ol
CID 105126839
3-(furan-2-yl)-N-[(1S)-1-pyridin-4-ylethyl]propanamide
CID 34761975
3-(furan-2-yl)-1-(4-methyl-3-pyridinyl)propan-1-amine
CID 105164227
(2R)-4-(furan-2-yl)-2-hydroxybutanoic acid
CID 141032870
1-(1-ethylimidazol-2-yl)-3-(furan-2-yl)propan-1-ol
CID 105098994
1,4-bis(furan-2-yl)butan-2-amine
CID 105177346
N'-[4-(furan-2-yl)butan-2-yl]benzenecarboximidamide
CID 55158629
1-(furan-2-yl)-6-methylheptan-3-ol
CID 105085501
1-[2-(furan-2-yl)ethyl]-3-[(R)-phenyl(pyridin-4-yl)methyl]urea
CID 95312794

Frequently Asked Questions

What is the IUPAC name of 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol?
The IUPAC name of 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol (CID 80525704) is 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol.
What is the SMILES notation for 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol?
The canonical SMILES for 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol is NCC(c1ccncc1)C(O)CCc1ccco1.
What is the InChIKey of 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol?
The InChIKey is QSSDXDCOESORNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c15-10-13(11-5-7-16-8-6-11)14(17)4-3-12-2-1-9-18-12/h1-2,5-9,13-14,17H,3-4,10,15H2.
What are the key properties of 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol?
1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol has a molecular weight of 246.31 g/mol, XLogP of 1.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-5-(furan-2-yl)-2-pyridin-4-ylpentan-3-ol is sourced from PubChem (CID 80525704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).