[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol

C12H16N4O — CID 61442010

IUPAC[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol
SMILESCN(Cc1cnn(C)c1)c1cc(CO)ccn1
InChIInChI=1S/C12H16N4O/c1-15(7-11-6-14-16(2)8-11)12-5-10(9-17)3-4-13-12/h3-6,8,17H,7,9H2,1-2H3
InChIKeyZWWLTAHLEFLGMF-UHFFFAOYSA-N
MW232.29 g/mol
LogP0.94
Rot. Bonds4

About [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol

[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol (PubChem CID 61442010) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol
PubChem CID61442010
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol
SMILESCN(Cc1cnn(C)c1)c1cc(CO)ccn1
InChIInChI=1S/C12H16N4O/c1-15(7-11-6-14-16(2)8-11)12-5-10(9-17)3-4-13-12/h3-6,8,17H,7,9H2,1-2H3
InChIKeyZWWLTAHLEFLGMF-UHFFFAOYSA-N
XLogP0.94
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62289751
[6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-2-pyridinyl]methanol
CID 62254806
[3-fluoro-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol
CID 105382972
[2-(dimethylamino)-4-pyridinyl]methanol
CID 22625066
[2-[2-(dimethylamino)ethyl-methylamino]-4-pyridinyl]methanol
CID 63698708
[2-[methyl-[(2-methylphenyl)methyl]amino]-4-pyridinyl]methanol
CID 61411894
6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridazine-3-carboxylic acid
CID 61440138
[2-[butyl(methyl)amino]-4-pyridinyl]methanol
CID 61254738
[2-[methyl-[(2-methylcyclopropyl)methyl]amino]-4-pyridinyl]methanol
CID 63864667
6-N-methyl-6-N-[(1-methylpyrazol-4-yl)methyl]pyridine-2,3,6-triamine
CID 79827181
5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
CID 107379754
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-5-(trifluoromethoxy)pyridin-2-amine
CID 133488581

Frequently Asked Questions

What is the IUPAC name of [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol?
The IUPAC name of [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol (CID 61442010) is [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol.
What is the SMILES notation for [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol?
The canonical SMILES for [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol is CN(Cc1cnn(C)c1)c1cc(CO)ccn1.
What is the InChIKey of [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol?
The InChIKey is ZWWLTAHLEFLGMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-15(7-11-6-14-16(2)8-11)12-5-10(9-17)3-4-13-12/h3-6,8,17H,7,9H2,1-2H3.
What are the key properties of [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol?
[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol has a molecular weight of 232.29 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol is sourced from PubChem (CID 61442010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).