N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide

C20H19N3O2 — CID 2472244

IUPACN-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide
SMILESC[C@H](NC(=O)CNC(=O)c1ccc2ccccc2c1)c1ccncc1
InChIInChI=1S/C20H19N3O2/c1-14(15-8-10-21-11-9-15)23-19(24)13-22-20(25)18-7-6-16-4-2-3-5-17(16)12-18/h2-12,14H,13H2,1H3,(H,22,25)(H,23,24)/t14-/m0/s1
InChIKeyZGFJDZIHSLJWKY-AWEZNQCLSA-N
MW333.39 g/mol
LogP2.84
Rot. Bonds5

About N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide

N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide (PubChem CID 2472244) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide
PubChem CID2472244
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide
SMILESC[C@H](NC(=O)CNC(=O)c1ccc2ccccc2c1)c1ccncc1
InChIInChI=1S/C20H19N3O2/c1-14(15-8-10-21-11-9-15)23-19(24)13-22-20(25)18-7-6-16-4-2-3-5-17(16)12-18/h2-12,14H,13H2,1H3,(H,22,25)(H,23,24)/t14-/m0/s1
InChIKeyZGFJDZIHSLJWKY-AWEZNQCLSA-N
XLogP2.84
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 ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-naphthalen-1-yl-N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]acetamide
CID 25356977
N-[(1R)-1-phenylethyl]naphthalene-2-carboxamide
CID 814202
N-[3-[1-(4-fluorophenyl)ethylamino]-3-oxopropyl]naphthalene-2-carboxamide
CID 43056250
3,4-dimethyl-N-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]benzamide
CID 7534879
1-naphthalen-2-yl-3-(1-pyridin-4-ylethyl)urea
CID 45147279
[(1S)-1-phenylethyl] 2-(naphthalene-2-carbonylamino)acetate
CID 7881119
4-naphthalen-2-yl-4-oxo-N-[(1R)-1-phenylethyl]butanamide
CID 8866306
2-amino-N-[2-oxo-2-(1-pyridin-4-ylethylamino)ethyl]acetamide
CID 60848302
2-(methylamino)-N-[(1S)-1-pyridin-4-ylethyl]acetamide
CID 81409723
N-[2-oxo-2-(1-pyridin-3-ylethylamino)ethyl]-1,3-benzodioxole-5-carboxamide
CID 18163065
N-[2-oxo-2-[[(1S)-1-pyridin-3-ylethyl]amino]ethyl]pyridine-3-carboxamide
CID 166223531
4-methyl-N-[2-oxo-2-[1-(4-phenylphenyl)ethylamino]ethyl]benzamide
CID 46578985

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide?
The IUPAC name of N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide (CID 2472244) is N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide is C[C@H](NC(=O)CNC(=O)c1ccc2ccccc2c1)c1ccncc1.
What is the InChIKey of N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide?
The InChIKey is ZGFJDZIHSLJWKY-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-14(15-8-10-21-11-9-15)23-19(24)13-22-20(25)18-7-6-16-4-2-3-5-17(16)12-18/h2-12,14H,13H2,1H3,(H,22,25)(H,23,24)/t14-/m0/s1.
What are the key properties of N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide?
N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]naphthalene-2-carboxamide is sourced from PubChem (CID 2472244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).