4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol

C14H23N3O — CID 62222040

IUPAC4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol
SMILESCCN(Cc1ccncc1)CC1(O)CCNCC1
InChIInChI=1S/C14H23N3O/c1-2-17(11-13-3-7-15-8-4-13)12-14(18)5-9-16-10-6-14/h3-4,7-8,16,18H,2,5-6,9-12H2,1H3
InChIKeyUCMIEOSXZYNLBL-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.02
Rot. Bonds5

About 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol

4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol (PubChem CID 62222040) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol
PubChem CID62222040
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol
SMILESCCN(Cc1ccncc1)CC1(O)CCNCC1
InChIInChI=1S/C14H23N3O/c1-2-17(11-13-3-7-15-8-4-13)12-14(18)5-9-16-10-6-14/h3-4,7-8,16,18H,2,5-6,9-12H2,1H3
InChIKeyUCMIEOSXZYNLBL-UHFFFAOYSA-N
XLogP1.02
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[methyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol
CID 62221509
N-cyclopropyl-4-ethyl-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 63128438
4-[[ethyl(2-hydroxyethyl)amino]methyl]piperidin-4-ol
CID 126846900
4-[1-[[ethyl(pyridin-4-ylmethyl)amino]methyl]cyclopropyl]aniline
CID 115913110
[(4R)-4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]-4-hydroxyazepan-1-yl]-(1H-indazol-3-yl)methanone
CID 124999055
1-[(3R)-3-[[ethyl(pyridin-4-ylmethyl)amino]methyl]-3-hydroxypyrrolidin-1-yl]-2-pyrazol-1-ylethanone
CID 124949348
[3-[[ethyl(pyridin-4-ylmethyl)amino]methyl]-3-hydroxypyrrolidin-1-yl]-(1,3-oxazol-5-yl)methanone
CID 110098082
N-[(4-piperidin-4-yloxyphenyl)methyl]-N-(pyridin-4-ylmethyl)ethanamine
CID 118759916
4-[(dipropylamino)methyl]piperidin-4-ol
CID 62221851
N-(pyridin-4-ylmethyl)-N-[[(2R)-pyrrolidin-2-yl]methyl]ethanamine
CID 102819441
(2-amino-4-methyl-1,3-thiazol-5-yl)-[4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]-4-hydroxyazepan-1-yl]methanone
CID 110123212
N-[[4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]oxan-4-yl]methyl]ethanamine
CID 62390449

Frequently Asked Questions

What is the IUPAC name of 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol?
The IUPAC name of 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol (CID 62222040) is 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol.
What is the SMILES notation for 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol?
The canonical SMILES for 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol is CCN(Cc1ccncc1)CC1(O)CCNCC1.
What is the InChIKey of 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol?
The InChIKey is UCMIEOSXZYNLBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-2-17(11-13-3-7-15-8-4-13)12-14(18)5-9-16-10-6-14/h3-4,7-8,16,18H,2,5-6,9-12H2,1H3.
What are the key properties of 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol?
4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol has a molecular weight of 249.36 g/mol, XLogP of 1.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[ethyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol is sourced from PubChem (CID 62222040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).