5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide

C13H22N4O — CID 107375376

IUPAC5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide
SMILESCCCCC(C)NC(=O)c1cnc(NCC)cn1
InChIInChI=1S/C13H22N4O/c1-4-6-7-10(3)17-13(18)11-8-16-12(9-15-11)14-5-2/h8-10H,4-7H2,1-3H3,(H,14,16)(H,17,18)
InChIKeyFSYYBCFCQRGLPL-UHFFFAOYSA-N
MW250.35 g/mol
LogP2.22
Rot. Bonds7

About 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide

5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide (PubChem CID 107375376) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide
PubChem CID107375376
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide
SMILESCCCCC(C)NC(=O)c1cnc(NCC)cn1
InChIInChI=1S/C13H22N4O/c1-4-6-7-10(3)17-13(18)11-8-16-12(9-15-11)14-5-2/h8-10H,4-7H2,1-3H3,(H,14,16)(H,17,18)
InChIKeyFSYYBCFCQRGLPL-UHFFFAOYSA-N
XLogP2.22
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(ethylamino)-N-pentan-2-ylpyrazine-2-carboxamide
CID 107373939
5-(ethylamino)-N-hexan-2-ylpyridine-2-carboxamide
CID 113436154
5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyrazine-2-carboxamide
CID 107377215
5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide
CID 106025870
5-(ethylamino)-N-(1-pyridin-2-ylethyl)pyrazine-2-carboxamide
CID 107374502
5-chloro-2-(ethylamino)-N-octan-2-ylpyridine-4-carboxamide
CID 114922691
5-(butylamino)-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272533
N-butyl-5-(2-methylpropylamino)pyrazine-2-carboxamide
CID 109272339
N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide
CID 109272804
N-(4-methylpentyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107375562
N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107375429
5-bromo-N-heptan-2-ylpyridine-2-carboxamide
CID 55153825

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide (CID 107375376) is 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide is CCCCC(C)NC(=O)c1cnc(NCC)cn1.
What is the InChIKey of 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide?
The InChIKey is FSYYBCFCQRGLPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-6-7-10(3)17-13(18)11-8-16-12(9-15-11)14-5-2/h8-10H,4-7H2,1-3H3,(H,14,16)(H,17,18).
What are the key properties of 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide?
5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 2.22, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-hexan-2-ylpyrazine-2-carboxamide is sourced from PubChem (CID 107375376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).