[4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol

C13H16N2O2 — CID 61423124

IUPAC[4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol
SMILESCCN(Cc1ccco1)c1ccnc(CO)c1
InChIInChI=1S/C13H16N2O2/c1-2-15(9-13-4-3-7-17-13)12-5-6-14-11(8-12)10-16/h3-8,16H,2,9-10H2,1H3
InChIKeyKTWUUPFXEKVRHO-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.19
Rot. Bonds5

About [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol

[4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol (PubChem CID 61423124) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol
PubChem CID61423124
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name[4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol
SMILESCCN(Cc1ccco1)c1ccnc(CO)c1
InChIInChI=1S/C13H16N2O2/c1-2-15(9-13-4-3-7-17-13)12-5-6-14-11(8-12)10-16/h3-8,16H,2,9-10H2,1H3
InChIKeyKTWUUPFXEKVRHO-UHFFFAOYSA-N
XLogP2.19
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)pyridin-4-amine
CID 62288315
N-ethyl-N-(furan-2-ylmethyl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 62288133
1-[ethyl-[2-(hydroxymethyl)-4-pyridinyl]amino]-2-methylpropan-2-ol
CID 79390496
N-ethyl-6-fluoro-N-(furan-2-ylmethyl)pyrimidin-4-amine
CID 115416612
5-amino-2-[ethyl(furan-2-ylmethyl)amino]pyridine-4-carboxylic acid
CID 114090156
3-(aminomethyl)-5-bromo-N-ethyl-N-(furan-2-ylmethyl)aniline
CID 102813620
5-ethoxy-3-N-ethyl-3-N-(furan-2-ylmethyl)benzene-1,3-diamine
CID 80730860
2-[[ethyl(furan-2-ylmethyl)amino]methyl]pyridin-4-amine
CID 79245146
[4-[bis(3-methylbutyl)amino]-2-pyridinyl]methanol
CID 107870750
6-(1-aminopropyl)-N-ethyl-N-(furan-2-ylmethyl)pyridin-3-amine
CID 112584265
2-chloro-N-ethyl-N-(pyridin-2-ylmethyl)pyridin-4-amine
CID 102809534
4-[(tert-butylamino)methyl]-N-ethyl-N-(furan-2-ylmethyl)aniline
CID 63060085

Frequently Asked Questions

What is the IUPAC name of [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol?
The IUPAC name of [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol (CID 61423124) is [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol.
What is the SMILES notation for [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol?
The canonical SMILES for [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol is CCN(Cc1ccco1)c1ccnc(CO)c1.
What is the InChIKey of [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol?
The InChIKey is KTWUUPFXEKVRHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-2-15(9-13-4-3-7-17-13)12-5-6-14-11(8-12)10-16/h3-8,16H,2,9-10H2,1H3.
What are the key properties of [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol?
[4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol has a molecular weight of 232.28 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[ethyl(furan-2-ylmethyl)amino]-2-pyridinyl]methanol is sourced from PubChem (CID 61423124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).