5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide

C14H15ClN4O2 — CID 62990773

IUPAC5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)NCc2ccnc(OC)c2)cc1Cl
InChIInChI=1S/C14H15ClN4O2/c1-16-13-11(15)6-10(8-18-13)14(20)19-7-9-3-4-17-12(5-9)21-2/h3-6,8H,7H2,1-2H3,(H,16,18)(H,19,20)
InChIKeySXIJYXIKTRCCCW-UHFFFAOYSA-N
MW306.75 g/mol
LogP2.11
Rot. Bonds5

About 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide

5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide (PubChem CID 62990773) has the molecular formula C14H15ClN4O2 and a molecular weight of 306.75 g/mol. Its IUPAC name is 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide
PubChem CID62990773
Molecular FormulaC14H15ClN4O2
Molecular Weight306.75 g/mol
Exact Mass306.09
IUPAC Name5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)NCc2ccnc(OC)c2)cc1Cl
InChIInChI=1S/C14H15ClN4O2/c1-16-13-11(15)6-10(8-18-13)14(20)19-7-9-3-4-17-12(5-9)21-2/h3-6,8H,7H2,1-2H3,(H,16,18)(H,19,20)
InChIKeySXIJYXIKTRCCCW-UHFFFAOYSA-N
XLogP2.11
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-6-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 62989408
5-chloro-N-[(4-methoxyphenyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62172418
4-amino-3,5-dichloro-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 82783281
5-chloro-N-[(3-chloro-4-fluorophenyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62531418
5-chloro-N-[(4-fluorophenyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62167616
N-[(2-methoxy-4-pyridinyl)methyl]pyridine-4-carboxamide
CID 47142420
6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 62073001
3-amino-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62072661
2-(2,6-dichlorophenyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 18167318
4-(ethylamino)-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62991671
N-[(2-methoxy-4-pyridinyl)methyl]-3-methyl-4-nitrobenzamide
CID 18155533
5-(ethylamino)-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-2-carboxamide
CID 104641230

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide (CID 62990773) is 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide is CNc1ncc(C(=O)NCc2ccnc(OC)c2)cc1Cl.
What is the InChIKey of 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide?
The InChIKey is SXIJYXIKTRCCCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN4O2/c1-16-13-11(15)6-10(8-18-13)14(20)19-7-9-3-4-17-12(5-9)21-2/h3-6,8H,7H2,1-2H3,(H,16,18)(H,19,20).
What are the key properties of 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide?
5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide has a molecular weight of 306.75 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]-6-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62990773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).