4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine

C12H19N3 — CID 177203757

IUPAC4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine
SMILESCc1cc(CN2CCCC(C)C2)ncn1
InChIInChI=1S/C12H19N3/c1-10-4-3-5-15(7-10)8-12-6-11(2)13-9-14-12/h6,9-10H,3-5,7-8H2,1-2H3
InChIKeyFHUUSVCAPQMOLV-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.02
Rot. Bonds2

About 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine

4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine (PubChem CID 177203757) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine.

Molecular Properties

Compound Name4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine
PubChem CID177203757
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine
SMILESCc1cc(CN2CCCC(C)C2)ncn1
InChIInChI=1S/C12H19N3/c1-10-4-3-5-15(7-10)8-12-6-11(2)13-9-14-12/h6,9-10H,3-5,7-8H2,1-2H3
InChIKeyFHUUSVCAPQMOLV-UHFFFAOYSA-N
XLogP2.02
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2-[(3-methylpiperidin-1-yl)methyl]pyrimidine
CID 177203554
4-[[(3R)-3-fluoro-3-methylpiperidin-1-yl]methyl]-6-methylpyrimidine
CID 129488024
[4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63888835
(3R)-3-methyl-1-[(4-methylphenyl)methyl]piperidine
CID 51531591
2-methyl-N-[[5-[(3-methylpiperidin-1-yl)methyl]-1,2-oxazol-3-yl]methyl]propan-2-amine
CID 62439446
2-(3-methylpiperidin-1-yl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 43107360
4-[(3-methylpiperidin-1-yl)methyl]pyridine
CID 121401070
[5-[(3-methylpiperidin-1-yl)methyl]furan-2-yl]methanamine
CID 62438530
1-benzyl-3-methylpiperidine
CID 2794856
N-[1-[[2-(dimethylamino)pyrimidin-5-yl]methyl]piperidin-3-yl]-6-methylpyrimidin-4-amine
CID 172881008
N-methyl-1-[2-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-4-yl]methanamine
CID 82193978
5-(bromomethyl)-2-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazole
CID 82424746

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine?
The IUPAC name of 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine (CID 177203757) is 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine.
What is the SMILES notation for 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine?
The canonical SMILES for 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine is Cc1cc(CN2CCCC(C)C2)ncn1.
What is the InChIKey of 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine?
The InChIKey is FHUUSVCAPQMOLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-10-4-3-5-15(7-10)8-12-6-11(2)13-9-14-12/h6,9-10H,3-5,7-8H2,1-2H3.
What are the key properties of 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine?
4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine has a molecular weight of 205.31 g/mol, XLogP of 2.02, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[(3-methylpiperidin-1-yl)methyl]pyrimidine is sourced from PubChem (CID 177203757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).