[3-[benzyl(ethyl)amino]-4-pyridinyl]methanol

C15H18N2O — CID 105066690

IUPAC[3-[benzyl(ethyl)amino]-4-pyridinyl]methanol
SMILESCCN(Cc1ccccc1)c1cnccc1CO
InChIInChI=1S/C15H18N2O/c1-2-17(11-13-6-4-3-5-7-13)15-10-16-9-8-14(15)12-18/h3-10,18H,2,11-12H2,1H3
InChIKeyAGTMXIKWXHUCBB-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.60
Rot. Bonds5

About [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol

[3-[benzyl(ethyl)amino]-4-pyridinyl]methanol (PubChem CID 105066690) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-[benzyl(ethyl)amino]-4-pyridinyl]methanol
PubChem CID105066690
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[3-[benzyl(ethyl)amino]-4-pyridinyl]methanol
SMILESCCN(Cc1ccccc1)c1cnccc1CO
InChIInChI=1S/C15H18N2O/c1-2-17(11-13-6-4-3-5-7-13)15-10-16-9-8-14(15)12-18/h3-10,18H,2,11-12H2,1H3
InChIKeyAGTMXIKWXHUCBB-UHFFFAOYSA-N
XLogP2.60
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(diethylamino)-4-pyridinyl]methanol
CID 105066644
[3-(N-ethylanilino)-4-pyridinyl]methanol
CID 105066676
[3-[ethyl(propyl)amino]-4-pyridinyl]methanol
CID 105066699
3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine
CID 81248963
1-[ethyl-[4-(hydroxymethyl)-3-pyridinyl]amino]-2-methylpropan-2-ol
CID 105066912
N-ethyl-4-(methylaminomethyl)-N-(pyridin-4-ylmethyl)pyridin-3-amine
CID 105073292
[3-(N-butylanilino)-4-pyridinyl]methanol
CID 105066896
[4-[benzyl(propan-2-yl)amino]-3-pyridinyl]methanol
CID 81237660
[2-[ethyl(pyridin-4-ylmethyl)amino]-5-fluorophenyl]methanol
CID 61448819
[2-chloro-4-[ethyl(pyridin-3-ylmethyl)amino]phenyl]methanol
CID 155811296
3-[ethyl(pyridin-4-ylmethyl)amino]pyridine-4-carbothioamide
CID 114288289
N-benzyl-4-(chloromethyl)-N-methylpyridin-3-amine
CID 105067251

Frequently Asked Questions

What is the IUPAC name of [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol?
The IUPAC name of [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol (CID 105066690) is [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol.
What is the SMILES notation for [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol?
The canonical SMILES for [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol is CCN(Cc1ccccc1)c1cnccc1CO.
What is the InChIKey of [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol?
The InChIKey is AGTMXIKWXHUCBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-2-17(11-13-6-4-3-5-7-13)15-10-16-9-8-14(15)12-18/h3-10,18H,2,11-12H2,1H3.
What are the key properties of [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol?
[3-[benzyl(ethyl)amino]-4-pyridinyl]methanol has a molecular weight of 242.32 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[benzyl(ethyl)amino]-4-pyridinyl]methanol is sourced from PubChem (CID 105066690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).