2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide

C18H19N3O3 — CID 129471163

IUPAC2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide
SMILESCOc1ncc(NC(=O)[C@H]2CCCc3ccccc32)cc1C(N)=O
InChIInChI=1S/C18H19N3O3/c1-24-18-15(16(19)22)9-12(10-20-18)21-17(23)14-8-4-6-11-5-2-3-7-13(11)14/h2-3,5,7,9-10,14H,4,6,8H2,1H3,(H2,19,22)(H,21,23)/t14-/m0/s1
InChIKeyLOQMGYZTIJCXJK-AWEZNQCLSA-N
MW325.37 g/mol
LogP2.25
Rot. Bonds4

About 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide

2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide (PubChem CID 129471163) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide
PubChem CID129471163
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide
SMILESCOc1ncc(NC(=O)[C@H]2CCCc3ccccc32)cc1C(N)=O
InChIInChI=1S/C18H19N3O3/c1-24-18-15(16(19)22)9-12(10-20-18)21-17(23)14-8-4-6-11-5-2-3-7-13(11)14/h2-3,5,7,9-10,14H,4,6,8H2,1H3,(H2,19,22)(H,21,23)/t14-/m0/s1
InChIKeyLOQMGYZTIJCXJK-AWEZNQCLSA-N
XLogP2.25
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-methoxy-5-phenylmethoxy-3-pyridinyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 141051472
2-methoxy-5-[[(2S)-pyrrolidine-2-carbonyl]amino]pyridine-3-carboxamide
CID 119897971
N-(4-carbamothioyl-1H-pyrazol-5-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 79497359
methyl 2-[4-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]phenoxy]acetate
CID 51949510
(1S)-N-[3-(2-methylsulfonylethoxy)phenyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 52512198
N-(2,4-dimethoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 134002451
N-(2-aminophenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 43600014
N-(3-methyl-4-pyridin-3-yloxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 60581044
N-(3-methylsulfanylphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 42946722
N-(3-amino-4-fluorophenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 62058346
N-(2,5-dimethylphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 42946523
(1R)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 51933448

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide?
The IUPAC name of 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide (CID 129471163) is 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide?
The canonical SMILES for 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide is COc1ncc(NC(=O)[C@H]2CCCc3ccccc32)cc1C(N)=O.
What is the InChIKey of 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide?
The InChIKey is LOQMGYZTIJCXJK-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-24-18-15(16(19)22)9-12(10-20-18)21-17(23)14-8-4-6-11-5-2-3-7-13(11)14/h2-3,5,7,9-10,14H,4,6,8H2,1H3,(H2,19,22)(H,21,23)/t14-/m0/s1.
What are the key properties of 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide?
2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide has a molecular weight of 325.37 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[[(1S)-1,2,3,4-tetrahydronaphthalene-1-carbonyl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 129471163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).