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

C14H24N4 — CID 116898301

IUPAC2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
SMILESCC(CN)Cc1nccc(C2CCCN(C)C2)n1
InChIInChI=1S/C14H24N4/c1-11(9-15)8-14-16-6-5-13(17-14)12-4-3-7-18(2)10-12/h5-6,11-12H,3-4,7-10,15H2,1-2H3
InChIKeyVQYFAZQRBBMTGB-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.42
Rot. Bonds4

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

2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine (PubChem CID 116898301) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
PubChem CID116898301
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
SMILESCC(CN)Cc1nccc(C2CCCN(C)C2)n1
InChIInChI=1S/C14H24N4/c1-11(9-15)8-14-16-6-5-13(17-14)12-4-3-7-18(2)10-12/h5-6,11-12H,3-4,7-10,15H2,1-2H3
InChIKeyVQYFAZQRBBMTGB-UHFFFAOYSA-N
XLogP1.42
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propanoic acid
CID 116900046
2-methyl-1-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-2-amine
CID 116898054
2-methyl-4-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]butan-2-amine
CID 116898479
[1-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]cyclobutyl]methanamine
CID 116902705
2-methyl-4-[4-(1-methylpyrrolidin-3-yl)pyrimidin-2-yl]butan-2-amine
CID 116898480
2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine
CID 116970815
[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]methanamine
CID 116892379
4-[(3S)-1-(2-methylpropyl)piperidin-3-yl]pyrimidin-2-amine
CID 95821349
4-cyclopropyl-2-(2-methylpropyl)pyrimidine
CID 70659268
4-(1-methylpiperidin-3-yl)-2-piperazin-1-ylpyrimidine
CID 116900754
4-(1-methylpyrrolidin-3-yl)-2-(pyrrolidin-2-ylmethyl)pyrimidine
CID 116898933
[4-[4-(1-methylpyrrolidin-3-yl)pyrimidin-2-yl]phenyl]methanamine
CID 116899105

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine?
The IUPAC name of 2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine (CID 116898301) is 2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine.
What is the SMILES notation for 2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine?
The canonical SMILES for 2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine is CC(CN)Cc1nccc(C2CCCN(C)C2)n1.
What is the InChIKey of 2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine?
The InChIKey is VQYFAZQRBBMTGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-11(9-15)8-14-16-6-5-13(17-14)12-4-3-7-18(2)10-12/h5-6,11-12H,3-4,7-10,15H2,1-2H3.
What are the key properties of 2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine?
2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine is sourced from PubChem (CID 116898301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).