[4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol

C16H20N2O — CID 102545154

IUPAC[4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol
SMILESCc1cc(NC(C)C)ncc1C(O)c1ccccc1
InChIInChI=1S/C16H20N2O/c1-11(2)18-15-9-12(3)14(10-17-15)16(19)13-7-5-4-6-8-13/h4-11,16,19H,1-3H3,(H,17,18)
InChIKeyUSKZXLYHVKNADF-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.29
Rot. Bonds4

About [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol

[4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol (PubChem CID 102545154) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol.

Molecular Properties

Compound Name[4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol
PubChem CID102545154
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name[4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol
SMILESCc1cc(NC(C)C)ncc1C(O)c1ccccc1
InChIInChI=1S/C16H20N2O/c1-11(2)18-15-9-12(3)14(10-17-15)16(19)13-7-5-4-6-8-13/h4-11,16,19H,1-3H3,(H,17,18)
InChIKeyUSKZXLYHVKNADF-UHFFFAOYSA-N
XLogP3.29
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[4-methyl-6-(methylamino)-3-pyridinyl]-phenylmethanol
CID 102545191
(S)-[4-methyl-6-(propylamino)-3-pyridinyl]-phenylmethanol
CID 124501809
[4-methyl-6-(propylamino)-3-pyridinyl]-phenylmethanol
CID 102545295
(S)-[6-(dimethylamino)-4-methyl-3-pyridinyl]-phenylmethanol
CID 124501757
(S)-(4-methyl-6-phenoxy-3-pyridinyl)-phenylmethanol
CID 124501783
(R)-(6-tert-butylsulfanyl-4-methyl-3-pyridinyl)-phenylmethanol
CID 124502131
(S)-[6-[ethyl(methyl)amino]-4-methyl-3-pyridinyl]-phenylmethanol
CID 124501822
5-chloro-4-methyl-N-propan-2-ylpyridin-2-amine
CID 58542754
(2,4-dimethylphenyl)-phenylmethanol
CID 3807153
5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine
CID 83265107
4-methyl-N-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine
CID 76850061
(1R)-1-[4-methyl-6-(methylamino)-3-pyridinyl]ethanol
CID 124501728

Frequently Asked Questions

What is the IUPAC name of [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol?
The IUPAC name of [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol (CID 102545154) is [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol.
What is the SMILES notation for [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol?
The canonical SMILES for [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol is Cc1cc(NC(C)C)ncc1C(O)c1ccccc1.
What is the InChIKey of [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol?
The InChIKey is USKZXLYHVKNADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11(2)18-15-9-12(3)14(10-17-15)16(19)13-7-5-4-6-8-13/h4-11,16,19H,1-3H3,(H,17,18).
What are the key properties of [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol?
[4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol has a molecular weight of 256.35 g/mol, XLogP of 3.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-6-(propan-2-ylamino)-3-pyridinyl]-phenylmethanol is sourced from PubChem (CID 102545154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).