N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide

C17H20N4O3 — CID 18167458

IUPACN-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2ccc(N3CCOCC3)nc2)ccn1
InChIInChI=1S/C17H20N4O3/c1-23-16-10-13(4-5-18-16)11-20-17(22)14-2-3-15(19-12-14)21-6-8-24-9-7-21/h2-5,10,12H,6-9,11H2,1H3,(H,20,22)
InChIKeyBHDWWJXULYWQRX-UHFFFAOYSA-N
MW328.37 g/mol
LogP1.25
Rot. Bonds5

About N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide

N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 18167458) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide
PubChem CID18167458
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC NameN-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2ccc(N3CCOCC3)nc2)ccn1
InChIInChI=1S/C17H20N4O3/c1-23-16-10-13(4-5-18-16)11-20-17(22)14-2-3-15(19-12-14)21-6-8-24-9-7-21/h2-5,10,12H,6-9,11H2,1H3,(H,20,22)
InChIKeyBHDWWJXULYWQRX-UHFFFAOYSA-N
XLogP1.25
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-methoxy-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]pyridine-3-carboxamide
CID 122318877
6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 62073001
N-[(2-methoxy-4-pyridinyl)methyl]morpholine-4-carboxamide
CID 34677256
N-[[4-(difluoromethyl)phenyl]methyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 166216056
N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 18167334
N-[(2-morpholin-4-yl-4-pyridinyl)methyl]-6-[[(2S)-oxolan-2-yl]methoxy]pyridine-3-carboxamide
CID 124891661
4-chloro-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 17424871
N-[(2-methoxy-4-pyridinyl)methyl]pyridine-4-carboxamide
CID 47142420
4-(methylsulfanylmethyl)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 30354650
3-fluoro-4-methyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
CID 32586803
2,5-dimethyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
CID 32585579
4-(2-methylpropoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 16602299

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide (CID 18167458) is N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide is COc1cc(CNC(=O)c2ccc(N3CCOCC3)nc2)ccn1.
What is the InChIKey of N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is BHDWWJXULYWQRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c1-23-16-10-13(4-5-18-16)11-20-17(22)14-2-3-15(19-12-14)21-6-8-24-9-7-21/h2-5,10,12H,6-9,11H2,1H3,(H,20,22).
What are the key properties of N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide?
N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 328.37 g/mol, XLogP of 1.25, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 18167458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).