1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol

C15H18N2O — CID 133482915

IUPAC1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol
SMILESCc1cccc(NCC(O)Cc2ccccc2)n1
InChIInChI=1S/C15H18N2O/c1-12-6-5-9-15(17-12)16-11-14(18)10-13-7-3-2-4-8-13/h2-9,14,18H,10-11H2,1H3,(H,16,17)
InChIKeyGITJZWMROVVTEB-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.41
Rot. Bonds5

About 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol

1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol (PubChem CID 133482915) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol.

Molecular Properties

Compound Name1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol
PubChem CID133482915
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol
SMILESCc1cccc(NCC(O)Cc2ccccc2)n1
InChIInChI=1S/C15H18N2O/c1-12-6-5-9-15(17-12)16-11-14(18)10-13-7-3-2-4-8-13/h2-9,14,18H,10-11H2,1H3,(H,16,17)
InChIKeyGITJZWMROVVTEB-UHFFFAOYSA-N
XLogP2.41
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(6-methyl-2-pyridinyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 10966962
1-(2-benzylbutyl)-3-(6-methyl-2-pyridinyl)thiourea
CID 133154601
(1R)-1-(3-methylphenyl)-2-[(6-methyl-2-pyridinyl)amino]ethanol
CID 99704551
1-[2-[(6-methyl-2-pyridinyl)amino]ethylamino]propan-2-ol
CID 104594292
1-cyclohexyl-2-[(6-methyl-2-pyridinyl)amino]ethanol
CID 133482857
ethyl 2-methyl-3-[(6-methyl-2-pyridinyl)amino]propanoate
CID 133483913
1-[(4-methoxypyrimidin-2-yl)amino]-3-phenylpropan-2-ol
CID 133289929
6-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)pyridin-2-amine
CID 133483564
N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
CID 95367778
6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine
CID 133483616
6-methyl-N-(2-thiophen-2-ylpropyl)pyridin-2-amine
CID 133483394
(2S)-1-anilino-3-(3-methylphenyl)propan-2-ol;methanesulfonic acid
CID 46833729

Frequently Asked Questions

What is the IUPAC name of 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol?
The IUPAC name of 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol (CID 133482915) is 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol.
What is the SMILES notation for 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol?
The canonical SMILES for 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol is Cc1cccc(NCC(O)Cc2ccccc2)n1.
What is the InChIKey of 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol?
The InChIKey is GITJZWMROVVTEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-12-6-5-9-15(17-12)16-11-14(18)10-13-7-3-2-4-8-13/h2-9,14,18H,10-11H2,1H3,(H,16,17).
What are the key properties of 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol?
1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol has a molecular weight of 242.32 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol is sourced from PubChem (CID 133482915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).