2-(2-methylanilino)-1-pyridin-3-ylethanol

C14H16N2O — CID 82040364

IUPAC2-(2-methylanilino)-1-pyridin-3-ylethanol
SMILESCc1ccccc1NCC(O)c1cccnc1
InChIInChI=1S/C14H16N2O/c1-11-5-2-3-7-13(11)16-10-14(17)12-6-4-8-15-9-12/h2-9,14,16-17H,10H2,1H3
InChIKeyNQIKHGAQXTYUPI-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.54
Rot. Bonds4

About 2-(2-methylanilino)-1-pyridin-3-ylethanol

2-(2-methylanilino)-1-pyridin-3-ylethanol (PubChem CID 82040364) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-(2-methylanilino)-1-pyridin-3-ylethanol.

Molecular Properties

Compound Name2-(2-methylanilino)-1-pyridin-3-ylethanol
PubChem CID82040364
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name2-(2-methylanilino)-1-pyridin-3-ylethanol
SMILESCc1ccccc1NCC(O)c1cccnc1
InChIInChI=1S/C14H16N2O/c1-11-5-2-3-7-13(11)16-10-14(17)12-6-4-8-15-9-12/h2-9,14,16-17H,10H2,1H3
InChIKeyNQIKHGAQXTYUPI-UHFFFAOYSA-N
XLogP2.54
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-2-(methylamino)-1-pyridin-3-ylethanol
CID 10171254
(2-hydroxy-2-pyridin-3-ylethyl)carbamic acid
CID 21105805
1-(4-fluoro-3-methylphenyl)-2-(2-methylanilino)ethanol
CID 82121205
1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol
CID 43499221
2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol
CID 82123675
2-[(3-chloro-4-pyridinyl)amino]-1-phenylethanol
CID 79839104
2-(2-phenylethylamino)-1-pyridin-3-ylethanol
CID 20826867
(1R)-2-phenyl-1-pyridin-3-ylethanol
CID 93312258
(1S)-1-(4-methylphenyl)-2-[[(1S)-1-pyridin-3-ylethyl]amino]ethanol
CID 97158238
4-methyl-1-pyridin-3-ylpent-4-en-1-ol
CID 114473785
1-(2-hydroxy-2-pyridin-3-ylethyl)-3-phenylurea
CID 23996231
2-(5-chloro-2-methylanilino)-1-phenylethanol
CID 60721635

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylanilino)-1-pyridin-3-ylethanol?
The IUPAC name of 2-(2-methylanilino)-1-pyridin-3-ylethanol (CID 82040364) is 2-(2-methylanilino)-1-pyridin-3-ylethanol.
What is the SMILES notation for 2-(2-methylanilino)-1-pyridin-3-ylethanol?
The canonical SMILES for 2-(2-methylanilino)-1-pyridin-3-ylethanol is Cc1ccccc1NCC(O)c1cccnc1.
What is the InChIKey of 2-(2-methylanilino)-1-pyridin-3-ylethanol?
The InChIKey is NQIKHGAQXTYUPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-11-5-2-3-7-13(11)16-10-14(17)12-6-4-8-15-9-12/h2-9,14,16-17H,10H2,1H3.
What are the key properties of 2-(2-methylanilino)-1-pyridin-3-ylethanol?
2-(2-methylanilino)-1-pyridin-3-ylethanol has a molecular weight of 228.30 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylanilino)-1-pyridin-3-ylethanol is sourced from PubChem (CID 82040364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).