(6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine

C11H18N4 — CID 62586721

IUPAC(6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine
SMILESCC1CCC(CN)CN1c1ccncn1
InChIInChI=1S/C11H18N4/c1-9-2-3-10(6-12)7-15(9)11-4-5-13-8-14-11/h4-5,8-10H,2-3,6-7,12H2,1H3
InChIKeyCFOLJDLMMLZSQE-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.04
Rot. Bonds2

About (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine

(6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine (PubChem CID 62586721) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine.

Molecular Properties

Compound Name(6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine
PubChem CID62586721
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name(6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine
SMILESCC1CCC(CN)CN1c1ccncn1
InChIInChI=1S/C11H18N4/c1-9-2-3-10(6-12)7-15(9)11-4-5-13-8-14-11/h4-5,8-10H,2-3,6-7,12H2,1H3
InChIKeyCFOLJDLMMLZSQE-UHFFFAOYSA-N
XLogP1.04
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine?
The IUPAC name of (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine (CID 62586721) is (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine.
What is the SMILES notation for (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine?
The canonical SMILES for (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine is CC1CCC(CN)CN1c1ccncn1.
What is the InChIKey of (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine?
The InChIKey is CFOLJDLMMLZSQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-9-2-3-10(6-12)7-15(9)11-4-5-13-8-14-11/h4-5,8-10H,2-3,6-7,12H2,1H3.
What are the key properties of (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine?
(6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine has a molecular weight of 206.29 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-1-pyrimidin-4-ylpiperidin-3-yl)methanamine is sourced from PubChem (CID 62586721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).