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

C13H14N4O2 — CID 55152846

IUPAC6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(N)nc2)cn1
InChIInChI=1S/C13H14N4O2/c1-19-12-5-2-9(6-16-12)7-17-13(18)10-3-4-11(14)15-8-10/h2-6,8H,7H2,1H3,(H2,14,15)(H,17,18)
InChIKeyIZKUNTHUKDHSJO-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.00
Rot. Bonds4

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

6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide (PubChem CID 55152846) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide
PubChem CID55152846
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(N)nc2)cn1
InChIInChI=1S/C13H14N4O2/c1-19-12-5-2-9(6-16-12)7-17-13(18)10-3-4-11(14)15-8-10/h2-6,8H,7H2,1H3,(H2,14,15)(H,17,18)
InChIKeyIZKUNTHUKDHSJO-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

1-N,4-N-bis[(6-methoxy-3-pyridinyl)methyl]benzene-1,4-dicarboxamide
CID 24646071
6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 62073001
3-amino-N-[(6-methoxy-3-pyridinyl)methyl]-4-methylbenzamide
CID 61275557
4-(ethylamino)-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 62991496
3,4-dichloro-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 51306023
N-[(6-methoxy-3-pyridinyl)methyl]-4-phenylbenzamide
CID 24589971
3,4-dihydroxy-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 103955476
6-amino-N-[(4-aminophenyl)methyl]pyridine-3-carboxamide
CID 89088351
2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 61250537
3,5-dichloro-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 16602233
6-amino-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
CID 62060168
N-[(6-methoxy-3-pyridinyl)methyl]-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103998680

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide (CID 55152846) is 6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide is COc1ccc(CNC(=O)c2ccc(N)nc2)cn1.
What is the InChIKey of 6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide?
The InChIKey is IZKUNTHUKDHSJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-19-12-5-2-9(6-16-12)7-17-13(18)10-3-4-11(14)15-8-10/h2-6,8H,7H2,1H3,(H2,14,15)(H,17,18).
What are the key properties of 6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide?
6-amino-N-[(6-methoxy-3-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-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 55152846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).