N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide

C14H21N3O2 — CID 109202858

IUPACN-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide
SMILESCC(C)CNC(=O)c1cc(N2CCOCC2)ccn1
InChIInChI=1S/C14H21N3O2/c1-11(2)10-16-14(18)13-9-12(3-4-15-13)17-5-7-19-8-6-17/h3-4,9,11H,5-8,10H2,1-2H3,(H,16,18)
InChIKeyYSHRDUSCPFCJGT-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.30
Rot. Bonds4

About N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide

N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide (PubChem CID 109202858) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide
PubChem CID109202858
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide
SMILESCC(C)CNC(=O)c1cc(N2CCOCC2)ccn1
InChIInChI=1S/C14H21N3O2/c1-11(2)10-16-14(18)13-9-12(3-4-15-13)17-5-7-19-8-6-17/h3-4,9,11H,5-8,10H2,1-2H3,(H,16,18)
InChIKeyYSHRDUSCPFCJGT-UHFFFAOYSA-N
XLogP1.30
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 ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide?
The IUPAC name of N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide (CID 109202858) is N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide?
The canonical SMILES for N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide is CC(C)CNC(=O)c1cc(N2CCOCC2)ccn1.
What is the InChIKey of N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide?
The InChIKey is YSHRDUSCPFCJGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-11(2)10-16-14(18)13-9-12(3-4-15-13)17-5-7-19-8-6-17/h3-4,9,11H,5-8,10H2,1-2H3,(H,16,18).
What are the key properties of N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide?
N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 109202858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).