6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide

C13H14N4O2 — CID 62073001

IUPAC6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2ccc(N)nc2)ccn1
InChIInChI=1S/C13H14N4O2/c1-19-12-6-9(4-5-15-12)7-17-13(18)10-2-3-11(14)16-8-10/h2-6,8H,7H2,1H3,(H2,14,16)(H,17,18)
InChIKeyLHTAPHMWMPKHRM-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.00
Rot. Bonds4

About 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide

6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide (PubChem CID 62073001) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
PubChem CID62073001
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
SMILESCOc1cc(CNC(=O)c2ccc(N)nc2)ccn1
InChIInChI=1S/C13H14N4O2/c1-19-12-6-9(4-5-15-12)7-17-13(18)10-2-3-11(14)16-8-10/h2-6,8H,7H2,1H3,(H2,14,16)(H,17,18)
InChIKeyLHTAPHMWMPKHRM-UHFFFAOYSA-N
XLogP1.00
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 55152846
N-[(2-methoxy-4-pyridinyl)methyl]pyridine-4-carboxamide
CID 47142420
4-amino-3,5-dichloro-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 82783281
3-amino-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62072661
4-(ethylamino)-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62991671
4-amino-N-[(2-methoxy-4-pyridinyl)methyl]-6-methylpyridine-3-carboxamide
CID 81242051
5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 62989408
4-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-2-carboxamide
CID 62991134
N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 18167458
5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62990773
N-[(2-methoxy-4-pyridinyl)methyl]-1H-indazole-6-carboxamide
CID 60721835
N-[(2-methoxy-4-pyridinyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 18167334

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide (CID 62073001) is 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide is COc1cc(CNC(=O)c2ccc(N)nc2)ccn1.
What is the InChIKey of 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide?
The InChIKey is LHTAPHMWMPKHRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-19-12-6-9(4-5-15-12)7-17-13(18)10-2-3-11(14)16-8-10/h2-6,8H,7H2,1H3,(H2,14,16)(H,17,18).
What are the key properties of 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide?
6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 62073001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).