N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide

C18H16N4O2 — CID 8990855

IUPACN-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide
SMILESO=C(NCCNC(=O)c1cnccn1)c1ccc2ccccc2c1
InChIInChI=1S/C18H16N4O2/c23-17(15-6-5-13-3-1-2-4-14(13)11-15)21-9-10-22-18(24)16-12-19-7-8-20-16/h1-8,11-12H,9-10H2,(H,21,23)(H,22,24)
InChIKeyFODNLMKNCZNDDL-UHFFFAOYSA-N
MW320.35 g/mol
LogP1.79
Rot. Bonds5

About N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide

N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide (PubChem CID 8990855) has the molecular formula C18H16N4O2 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide
PubChem CID8990855
Molecular FormulaC18H16N4O2
Molecular Weight320.35 g/mol
Exact Mass320.13
IUPAC NameN-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide
SMILESO=C(NCCNC(=O)c1cnccn1)c1ccc2ccccc2c1
InChIInChI=1S/C18H16N4O2/c23-17(15-6-5-13-3-1-2-4-14(13)11-15)21-9-10-22-18(24)16-12-19-7-8-20-16/h1-8,11-12H,9-10H2,(H,21,23)(H,22,24)
InChIKeyFODNLMKNCZNDDL-UHFFFAOYSA-N
XLogP1.79
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[(3-iodobenzoyl)amino]ethyl]pyrazine-2-carboxamide
CID 8990844
N-(2-hydroxyethyl)naphthalene-2-carboxamide
CID 13288324
N-[2-[[4-(2-oxochromen-3-yl)benzoyl]amino]ethyl]pyrazine-2-carboxamide
CID 8990856
N-[4-(naphthalene-2-carbonylamino)butyl]naphthalene-2-carboxamide
CID 101181857
N-(2-hydroxyethyl)pyrazine-2-carboxamide
CID 14230272
N-(2-phenylsulfanylethyl)pyrazine-2-carboxamide
CID 27887675
N-propylnaphthalene-2-carboxamide
CID 6624536
N-[10-(pyrazine-2-carbonylamino)decyl]pyrazine-2-carboxamide
CID 71517100
3-phenyl-N-[2-(pyrazine-2-carbonylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide
CID 16764583
ethyl [4-[2-(pyrazine-2-carbonylamino)ethylcarbamoyl]phenyl] carbonate
CID 108537576
N-(3-hydroxypropyl)isoquinoline-6-carboxamide
CID 110485097
N-[2-(pyrazine-2-carbonylamino)ethyl]-1,3-benzothiazole-2-carboxamide
CID 30370261

Frequently Asked Questions

What is the IUPAC name of N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide?
The IUPAC name of N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide (CID 8990855) is N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide is O=C(NCCNC(=O)c1cnccn1)c1ccc2ccccc2c1.
What is the InChIKey of N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide?
The InChIKey is FODNLMKNCZNDDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2/c23-17(15-6-5-13-3-1-2-4-14(13)11-15)21-9-10-22-18(24)16-12-19-7-8-20-16/h1-8,11-12H,9-10H2,(H,21,23)(H,22,24).
What are the key properties of N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide?
N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide has a molecular weight of 320.35 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(naphthalene-2-carbonylamino)ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 8990855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).