N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide

C14H21N3O2 — CID 104641380

IUPACN-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)N(C)CC2CCCOC2)nc1
InChIInChI=1S/C14H21N3O2/c1-15-12-5-6-13(16-8-12)14(18)17(2)9-11-4-3-7-19-10-11/h5-6,8,11,15H,3-4,7,9-10H2,1-2H3
InChIKeyUEYJZVLFNWMVLC-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.62
Rot. Bonds4

About N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide

N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide (PubChem CID 104641380) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide
PubChem CID104641380
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)N(C)CC2CCCOC2)nc1
InChIInChI=1S/C14H21N3O2/c1-15-12-5-6-13(16-8-12)14(18)17(2)9-11-4-3-7-19-10-11/h5-6,8,11,15H,3-4,7,9-10H2,1-2H3
InChIKeyUEYJZVLFNWMVLC-UHFFFAOYSA-N
XLogP1.62
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide (CID 104641380) is N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide is CNc1ccc(C(=O)N(C)CC2CCCOC2)nc1.
What is the InChIKey of N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide?
The InChIKey is UEYJZVLFNWMVLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-15-12-5-6-13(16-8-12)14(18)17(2)9-11-4-3-7-19-10-11/h5-6,8,11,15H,3-4,7,9-10H2,1-2H3.
What are the key properties of N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide?
N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(methylamino)-N-(oxan-3-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 104641380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).