6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol

C17H23N3O — CID 79781685

IUPAC6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol
SMILESCCN(CC)Cc1cccc(NCc2ccc(O)cn2)c1
InChIInChI=1S/C17H23N3O/c1-3-20(4-2)13-14-6-5-7-15(10-14)18-11-16-8-9-17(21)12-19-16/h5-10,12,18,21H,3-4,11,13H2,1-2H3
InChIKeyQGHUZDNSMFEVLR-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.24
Rot. Bonds7

About 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol

6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol (PubChem CID 79781685) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol
PubChem CID79781685
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol
SMILESCCN(CC)Cc1cccc(NCc2ccc(O)cn2)c1
InChIInChI=1S/C17H23N3O/c1-3-20(4-2)13-14-6-5-7-15(10-14)18-11-16-8-9-17(21)12-19-16/h5-10,12,18,21H,3-4,11,13H2,1-2H3
InChIKeyQGHUZDNSMFEVLR-UHFFFAOYSA-N
XLogP3.24
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(anilinomethyl)pyridin-3-ol
CID 79787965
methyl 3-[(5-hydroxy-2-pyridinyl)methylamino]benzoate
CID 79775423
6-[(3-butan-2-yloxyanilino)methyl]pyridin-3-ol
CID 79794177
N-[(4-chlorophenyl)methyl]-3-(diethylaminomethyl)aniline
CID 43435845
3-(diethylaminomethyl)-N-[(3-fluorophenyl)methyl]aniline
CID 43727006
3-(diethylaminomethyl)-N-[(1-ethylpyrazol-4-yl)methyl]aniline
CID 103720547
3-[(5-methyl-2-pyridinyl)methylamino]phenol
CID 81311516
3-(diethylaminomethyl)-N-[(1-methylpyrrol-3-yl)methyl]aniline
CID 66398542
6-[[3-chloro-4-(dimethylamino)anilino]methyl]pyridin-3-ol
CID 79781509
N-[(5-bromothiophen-3-yl)methyl]-3-(diethylaminomethyl)aniline
CID 43727058
N-[3-(diethylaminomethyl)phenyl]-1,3-thiazole-4-carboxamide
CID 63050106
N-[4-[(5-hydroxy-2-pyridinyl)methylamino]phenyl]acetamide
CID 79776095

Frequently Asked Questions

What is the IUPAC name of 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol?
The IUPAC name of 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol (CID 79781685) is 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol?
The canonical SMILES for 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol is CCN(CC)Cc1cccc(NCc2ccc(O)cn2)c1.
What is the InChIKey of 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol?
The InChIKey is QGHUZDNSMFEVLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-3-20(4-2)13-14-6-5-7-15(10-14)18-11-16-8-9-17(21)12-19-16/h5-10,12,18,21H,3-4,11,13H2,1-2H3.
What are the key properties of 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol?
6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol has a molecular weight of 285.39 g/mol, XLogP of 3.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[3-(diethylaminomethyl)anilino]methyl]pyridin-3-ol is sourced from PubChem (CID 79781685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).