6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide

C20H19N3O2 — CID 8990934

IUPAC6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NCCNC(=O)c2cccc3ccccc23)cn1
InChIInChI=1S/C20H19N3O2/c1-14-9-10-16(13-23-14)19(24)21-11-12-22-20(25)18-8-4-6-15-5-2-3-7-17(15)18/h2-10,13H,11-12H2,1H3,(H,21,24)(H,22,25)
InChIKeyBNGNKKXANVAGAX-UHFFFAOYSA-N
MW333.39 g/mol
LogP2.70
Rot. Bonds5

About 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide

6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide (PubChem CID 8990934) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide
PubChem CID8990934
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NCCNC(=O)c2cccc3ccccc23)cn1
InChIInChI=1S/C20H19N3O2/c1-14-9-10-16(13-23-14)19(24)21-11-12-22-20(25)18-8-4-6-15-5-2-3-7-17(15)18/h2-10,13H,11-12H2,1H3,(H,21,24)(H,22,25)
InChIKeyBNGNKKXANVAGAX-UHFFFAOYSA-N
XLogP2.70
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[(2-iodobenzoyl)amino]ethyl]-6-methylpyridine-3-carboxamide
CID 8990901
6-methyl-N-[2-(methylamino)ethyl]pyridine-3-carboxamide
CID 62657976
6-methyl-N-[2-[(2-phenylacetyl)amino]ethyl]pyridine-3-carboxamide
CID 6498633
6-methyl-N-[3-[(6-methylpyridine-3-carbonyl)amino]propyl]pyridine-3-carboxamide
CID 3159007
N-[2-[(3-fluoro-4-methylbenzoyl)amino]ethyl]naphthalene-1-carboxamide
CID 35350648
N-(3-hydroxypropyl)-6-methylpyridine-3-carboxamide
CID 43417610
N-[2-[[4-(methanesulfonamido)benzoyl]amino]ethyl]naphthalene-1-carboxamide
CID 108540776
6-methyl-N-[3-[(2-methyl-3-nitrobenzoyl)amino]propyl]pyridine-3-carboxamide
CID 8990949
N-[11-(naphthalene-1-carbonylamino)undecyl]naphthalene-1-carboxamide
CID 137492009
N-[2-[(3-bromobenzoyl)amino]ethyl]naphthalene-1-carboxamide
CID 108539666
2-methyl-5-[(2E,4E)-5-naphthalen-1-ylhexa-2,4-dien-2-yl]pyridine
CID 170229762
N-(3-chloropropyl)naphthalene-1-carboxamide
CID 17164120

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide (CID 8990934) is 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide is Cc1ccc(C(=O)NCCNC(=O)c2cccc3ccccc23)cn1.
What is the InChIKey of 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide?
The InChIKey is BNGNKKXANVAGAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-14-9-10-16(13-23-14)19(24)21-11-12-22-20(25)18-8-4-6-15-5-2-3-7-17(15)18/h2-10,13H,11-12H2,1H3,(H,21,24)(H,22,25).
What are the key properties of 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide?
6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 2.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[2-(naphthalene-1-carbonylamino)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 8990934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).