2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine

C14H24N4 — CID 116892733

IUPAC2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
SMILESCc1cc(C2CCCN(C)C2)nc(C(C)CN)n1
InChIInChI=1S/C14H24N4/c1-10(8-15)14-16-11(2)7-13(17-14)12-5-4-6-18(3)9-12/h7,10,12H,4-6,8-9,15H2,1-3H3
InChIKeyJZRCQPOKGKTFFO-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.66
Rot. Bonds3

About 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine

2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine (PubChem CID 116892733) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine.

Molecular Properties

Compound Name2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
PubChem CID116892733
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
SMILESCc1cc(C2CCCN(C)C2)nc(C(C)CN)n1
InChIInChI=1S/C14H24N4/c1-10(8-15)14-16-11(2)7-13(17-14)12-5-4-6-18(3)9-12/h7,10,12H,4-6,8-9,15H2,1-3H3
InChIKeyJZRCQPOKGKTFFO-UHFFFAOYSA-N
XLogP1.66
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]methanamine
CID 116892379
[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]methanethiol
CID 116894539
4-methyl-6-(1-methylpiperidin-3-yl)-2-(piperidin-1-ylmethyl)pyrimidine
CID 172524149
4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine
CID 116893403
N,N,2-trimethyl-6-[(3R)-1-methylpiperidin-3-yl]pyridin-4-amine
CID 125000369
2-amino-1-(4-cyclopentyl-6-methylpyrimidin-2-yl)ethanol
CID 116895876
N-[[4-methyl-6-(1-methylpyrrolidin-3-yl)pyrimidin-2-yl]methyl]propan-2-amine
CID 116893231
2-(methylamino)-2-[4-methyl-6-(1-methylpyrrolidin-3-yl)pyrimidin-2-yl]acetic acid
CID 116896647
2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
CID 116898301
1-(4-cyclopentyl-6-methylpyrimidin-2-yl)propan-1-amine
CID 63319216
1-(4-cyclopropyl-6-methylpyrimidin-2-yl)ethanamine
CID 63318658
N,4-dimethyl-6-(1-methylpyrrolidin-3-yl)pyrimidin-2-amine
CID 116894677

Frequently Asked Questions

What is the IUPAC name of 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine?
The IUPAC name of 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine (CID 116892733) is 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine.
What is the SMILES notation for 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine?
The canonical SMILES for 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine is Cc1cc(C2CCCN(C)C2)nc(C(C)CN)n1.
What is the InChIKey of 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine?
The InChIKey is JZRCQPOKGKTFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-10(8-15)14-16-11(2)7-13(17-14)12-5-4-6-18(3)9-12/h7,10,12H,4-6,8-9,15H2,1-3H3.
What are the key properties of 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine?
2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine is sourced from PubChem (CID 116892733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).