N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine

C15H24N4 — CID 83186348

IUPACN-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine
SMILESCc1nc(N2CCCCC2C)ncc1CNC1CC1
InChIInChI=1S/C15H24N4/c1-11-5-3-4-8-19(11)15-17-10-13(12(2)18-15)9-16-14-6-7-14/h10-11,14,16H,3-9H2,1-2H3
InChIKeyCYDWQBRNPNOZOQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.42
Rot. Bonds4

About N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine

N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine (PubChem CID 83186348) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine
PubChem CID83186348
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC NameN-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine
SMILESCc1nc(N2CCCCC2C)ncc1CNC1CC1
InChIInChI=1S/C15H24N4/c1-11-5-3-4-8-19(11)15-17-10-13(12(2)18-15)9-16-14-6-7-14/h10-11,14,16H,3-9H2,1-2H3
InChIKeyCYDWQBRNPNOZOQ-UHFFFAOYSA-N
XLogP2.42
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine (CID 83186348) is N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine is Cc1nc(N2CCCCC2C)ncc1CNC1CC1.
What is the InChIKey of N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine?
The InChIKey is CYDWQBRNPNOZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-11-5-3-4-8-19(11)15-17-10-13(12(2)18-15)9-16-14-6-7-14/h10-11,14,16H,3-9H2,1-2H3.
What are the key properties of N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine?
N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine has a molecular weight of 260.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine is sourced from PubChem (CID 83186348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).