[2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol

C15H18N2O — CID 61411894

IUPAC[2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol
SMILESCc1ccccc1CN(C)c1cc(CO)ccn1
InChIInChI=1S/C15H18N2O/c1-12-5-3-4-6-14(12)10-17(2)15-9-13(11-18)7-8-16-15/h3-9,18H,10-11H2,1-2H3
InChIKeyABNXQZZCDWUBPP-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.52
Rot. Bonds4

About [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol

[2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol (PubChem CID 61411894) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol
PubChem CID61411894
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol
SMILESCc1ccccc1CN(C)c1cc(CO)ccn1
InChIInChI=1S/C15H18N2O/c1-12-5-3-4-6-14(12)10-17(2)15-9-13(11-18)7-8-16-15/h3-9,18H,10-11H2,1-2H3
InChIKeyABNXQZZCDWUBPP-UHFFFAOYSA-N
XLogP2.52
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(2-chlorophenyl)methyl-methylamino]-4-pyridinyl]methanol
CID 61417390
N-methyl-N-[(2-methylphenyl)methyl]-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62287039
[3-chloro-4-[methyl-[(2-methylphenyl)methyl]amino]phenyl]methanol
CID 81151392
[2-(dimethylamino)-4-pyridinyl]methanol
CID 22625066
[2-[2-(dimethylamino)ethyl-methylamino]-4-pyridinyl]methanol
CID 63698708
[2-[methyl(2-pyridin-2-ylethyl)amino]-4-pyridinyl]methanol
CID 61256233
[2-[butyl(methyl)amino]-4-pyridinyl]methanol
CID 61254738
[2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol
CID 63864667
[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol
CID 61442010
[3-fluoro-5-[methyl-[(2-methylphenyl)methyl]amino]phenyl]methanol
CID 106529738
N-[(2-chlorophenyl)methyl]-N-methyl-4-(methylaminomethyl)pyridin-2-amine
CID 62288918
N-[(2-bromophenyl)methyl]-N-methyl-4-(methylaminomethyl)pyridin-2-amine
CID 62293554

Frequently Asked Questions

What is the IUPAC name of [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol?
The IUPAC name of [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol (CID 61411894) is [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol.
What is the SMILES notation for [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol?
The canonical SMILES for [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol is Cc1ccccc1CN(C)c1cc(CO)ccn1.
What is the InChIKey of [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol?
The InChIKey is ABNXQZZCDWUBPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-12-5-3-4-6-14(12)10-17(2)15-9-13(11-18)7-8-16-15/h3-9,18H,10-11H2,1-2H3.
What are the key properties of [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol?
[2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol has a molecular weight of 242.32 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol is sourced from PubChem (CID 61411894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).