6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine

C17H23N5 — CID 110257270

IUPAC6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
SMILESCc1cc(NCc2ccccn2)nc(C2CCCN(C)C2)n1
InChIInChI=1S/C17H23N5/c1-13-10-16(19-11-15-7-3-4-8-18-15)21-17(20-13)14-6-5-9-22(2)12-14/h3-4,7-8,10,14H,5-6,9,11-12H2,1-2H3,(H,19,20,21)
InChIKeyDDEZYYRSGIVHJX-UHFFFAOYSA-N
MW297.41 g/mol
LogP2.60
Rot. Bonds4

About 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine

6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine (PubChem CID 110257270) has the molecular formula C17H23N5 and a molecular weight of 297.41 g/mol. Its IUPAC name is 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
PubChem CID110257270
Molecular FormulaC17H23N5
Molecular Weight297.41 g/mol
Exact Mass297.20
IUPAC Name6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
SMILESCc1cc(NCc2ccccn2)nc(C2CCCN(C)C2)n1
InChIInChI=1S/C17H23N5/c1-13-10-16(19-11-15-7-3-4-8-18-15)21-17(20-13)14-6-5-9-22(2)12-14/h3-4,7-8,10,14H,5-6,9,11-12H2,1-2H3,(H,19,20,21)
InChIKeyDDEZYYRSGIVHJX-UHFFFAOYSA-N
XLogP2.60
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.41
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(1-methylazepan-4-yl)methyl]-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 110257678
6-methyl-2-[(3R)-1-methylpiperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine
CID 95820185
2-chloro-6-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 62476257
4-methyl-2-(1-methylpiperidin-3-yl)pyrimidine
CID 122609712
6-methyl-2-morpholin-4-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 112912256
6-methyl-2-(4-phenylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 112919106
2-[(3R)-3-[4-methyl-6-(pyrimidin-2-ylamino)pyrimidin-2-yl]piperidin-1-yl]ethanol
CID 95820195
2-[(3S)-3-[4-methyl-6-(pyrimidin-2-ylamino)pyrimidin-2-yl]piperidin-1-yl]ethanol
CID 95820196
4-N-benzyl-6-methyl-2-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112915471
4,5-dimethyl-N-[6-methyl-2-(1-methylpiperidin-3-yl)pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 110095386
6-methyl-2-N-(4-piperidin-1-ylphenyl)-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112919208
1-methyl-N-(pyridin-2-ylmethyl)azepan-4-amine
CID 65071092

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine (CID 110257270) is 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine is Cc1cc(NCc2ccccn2)nc(C2CCCN(C)C2)n1.
What is the InChIKey of 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
The InChIKey is DDEZYYRSGIVHJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5/c1-13-10-16(19-11-15-7-3-4-8-18-15)21-17(20-13)14-6-5-9-22(2)12-14/h3-4,7-8,10,14H,5-6,9,11-12H2,1-2H3,(H,19,20,21).
What are the key properties of 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine has a molecular weight of 297.41 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 110257270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).