2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol

C15H18N2O — CID 61045318

IUPAC2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol
SMILESCc1ccc(NC(C)(CO)c2cccnc2)cc1
InChIInChI=1S/C15H18N2O/c1-12-5-7-14(8-6-12)17-15(2,11-18)13-4-3-9-16-10-13/h3-10,17-18H,11H2,1-2H3
InChIKeyMVMYOTAVVJVHJK-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.71
Rot. Bonds4

About 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol

2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol (PubChem CID 61045318) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol.

Molecular Properties

Compound Name2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol
PubChem CID61045318
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol
SMILESCc1ccc(NC(C)(CO)c2cccnc2)cc1
InChIInChI=1S/C15H18N2O/c1-12-5-7-14(8-6-12)17-15(2,11-18)13-4-3-9-16-10-13/h3-10,17-18H,11H2,1-2H3
InChIKeyMVMYOTAVVJVHJK-UHFFFAOYSA-N
XLogP2.71
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-methylanilino)-2-pyridin-3-ylpropan-1-ol
CID 61046057
2-(3-methoxyphenyl)-2-(4-methylanilino)propan-1-ol
CID 61045679
2-methyl-2-pyridin-3-ylpropane-1,3-diol
CID 130130273
(2R)-2-(4-chloroanilino)-2-pyridin-3-ylpropanenitrile
CID 825086
2,4-dimethyl-4-pyridin-3-ylpentan-2-ol
CID 145044151
2-[(5-bromo-3-pyridinyl)amino]-2-phenylpropan-1-ol
CID 105058658
2-(4-bromoanilino)-2-pyridin-3-ylpropanoic acid
CID 60993841
2-(4-fluoroanilino)-2-pyridin-3-ylpropanoic acid
CID 60991839
3-(methylamino)-3-pyridin-3-ylbutanamide
CID 65236236
2-(4-bromoanilino)-2-(3-methoxyphenyl)propan-1-ol
CID 61049856
N-(chloromethyl)-2-methyl-2-pyridin-3-ylpropan-1-amine
CID 115263711
methyl 2-methyl-2-pyridin-3-ylpropanoate
CID 54537815

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol?
The IUPAC name of 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol (CID 61045318) is 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol.
What is the SMILES notation for 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol?
The canonical SMILES for 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol is Cc1ccc(NC(C)(CO)c2cccnc2)cc1.
What is the InChIKey of 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol?
The InChIKey is MVMYOTAVVJVHJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-12-5-7-14(8-6-12)17-15(2,11-18)13-4-3-9-16-10-13/h3-10,17-18H,11H2,1-2H3.
What are the key properties of 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol?
2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol has a molecular weight of 242.32 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylanilino)-2-pyridin-3-ylpropan-1-ol is sourced from PubChem (CID 61045318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).