4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine

C11H17N3 — CID 89079553

IUPAC4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine
SMILESCc1ccnc(N2CCCC(C)C2)n1
InChIInChI=1S/C11H17N3/c1-9-4-3-7-14(8-9)11-12-6-5-10(2)13-11/h5-6,9H,3-4,7-8H2,1-2H3
InChIKeyVFEJTSWGNVONRE-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.02
Rot. Bonds1

About 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine

4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine (PubChem CID 89079553) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine.

Molecular Properties

Compound Name4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine
PubChem CID89079553
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine
SMILESCc1ccnc(N2CCCC(C)C2)n1
InChIInChI=1S/C11H17N3/c1-9-4-3-7-14(8-9)11-12-6-5-10(2)13-11/h5-6,9H,3-4,7-8H2,1-2H3
InChIKeyVFEJTSWGNVONRE-UHFFFAOYSA-N
XLogP2.02
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3S)-3-fluoropiperidin-1-yl]-4-methylpyrimidine
CID 129349446
2-(3-methylpiperidin-1-yl)-4-(4-methylpiperidin-1-yl)pyrimidine
CID 112885128
methanol;2-(3-methylpiperidin-1-yl)pyrimidin-4-amine
CID 156802158
2-[3-(methoxymethyl)piperidin-1-yl]-4-methylpyrimidine
CID 133310053
2-(3,4-dimethylpiperazin-1-yl)-4-methylpyrimidine
CID 123999488
ethane;4-methyl-2-pyrrolidin-1-ylpyrimidine
CID 178079017
N-methyl-1-[1-(4-methylpyrimidin-2-yl)piperidin-3-yl]methanamine
CID 62958741
2-N,2-N,4-N-trimethyl-4-N-[1-(4-methylpyrimidin-2-yl)piperidin-3-yl]pyrimidine-2,4-diamine
CID 172899884
4-methyl-2-[3-(2-methyl-1,3-dioxolan-2-yl)piperidin-1-yl]pyrimidine
CID 75503323
4-methyl-2-(3-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine
CID 62958401
N,N-dimethyl-1-(4-methylpyrimidin-2-yl)pyrrolidin-3-amine
CID 123144666
4-methyl-2-(3-methylpiperazin-1-yl)pyrimidine;hydrochloride
CID 71639412

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine?
The IUPAC name of 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine (CID 89079553) is 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine.
What is the SMILES notation for 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine?
The canonical SMILES for 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine is Cc1ccnc(N2CCCC(C)C2)n1.
What is the InChIKey of 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine?
The InChIKey is VFEJTSWGNVONRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-9-4-3-7-14(8-9)11-12-6-5-10(2)13-11/h5-6,9H,3-4,7-8H2,1-2H3.
What are the key properties of 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine?
4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine has a molecular weight of 191.28 g/mol, XLogP of 2.02, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine is sourced from PubChem (CID 89079553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).