[4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol

C13H17N5O — CID 138019403

IUPAC[4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol
SMILESCNc1cc(CNc2cc(C)nc(CO)n2)ccn1
InChIInChI=1S/C13H17N5O/c1-9-5-12(18-13(8-19)17-9)16-7-10-3-4-15-11(6-10)14-2/h3-6,19H,7-8H2,1-2H3,(H,14,15)(H,16,17,18)
InChIKeyIKUUEAQBWVDXRN-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.33
Rot. Bonds5

About [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol

[4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol (PubChem CID 138019403) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol.

Molecular Properties

Compound Name[4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol
PubChem CID138019403
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name[4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol
SMILESCNc1cc(CNc2cc(C)nc(CO)n2)ccn1
InChIInChI=1S/C13H17N5O/c1-9-5-12(18-13(8-19)17-9)16-7-10-3-4-15-11(6-10)14-2/h3-6,19H,7-8H2,1-2H3,(H,14,15)(H,16,17,18)
InChIKeyIKUUEAQBWVDXRN-UHFFFAOYSA-N
XLogP1.33
TPSA82.96 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol 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

[4-methyl-6-(2-methylpropylamino)pyrimidin-2-yl]methanol
CID 130917983
4-N-[(2-methoxy-4-pyridinyl)methyl]-6-N-methylpyrimidine-2,4,6-triamine
CID 80831217
2-ethyl-6-N-methyl-4-N-[(6-methyl-3-pyridinyl)methyl]pyrimidine-4,6-diamine
CID 80934553
methyl 4-[[4-(hydroxymethyl)phenyl]methylamino]-6-methylpyrimidine-2-carboxylate
CID 107232375
2-ethyl-N,6-dimethylpyrimidin-4-amine
CID 62192654
2-[[4-methyl-6-(methylamino)pyrimidin-2-yl]methyl-propylamino]ethanol
CID 80658221
2-methyl-3-[[2-(methylamino)-4-pyridinyl]methylsulfanyl]propan-1-ol
CID 66103427
(2-hydrazinyl-4-pyridinyl)methanol
CID 59843154
2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine
CID 167795619
4-N-[(3-chlorophenyl)methyl]-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80833016
[4-[[(2S)-1-fluoropropan-2-yl]amino]-6-methylpyrimidin-2-yl]methanol
CID 131160481
(2-methyl-4-pyridinyl)methanol;hydrochloride
CID 171364039

Frequently Asked Questions

What is the IUPAC name of [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol?
The IUPAC name of [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol (CID 138019403) is [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol.
What is the SMILES notation for [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol?
The canonical SMILES for [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol is CNc1cc(CNc2cc(C)nc(CO)n2)ccn1.
What is the InChIKey of [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol?
The InChIKey is IKUUEAQBWVDXRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-9-5-12(18-13(8-19)17-9)16-7-10-3-4-15-11(6-10)14-2/h3-6,19H,7-8H2,1-2H3,(H,14,15)(H,16,17,18).
What are the key properties of [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol?
[4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol has a molecular weight of 259.31 g/mol, XLogP of 1.33, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-6-[[2-(methylamino)-4-pyridinyl]methylamino]pyrimidin-2-yl]methanol is sourced from PubChem (CID 138019403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).