N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide

C17H24N4O2 — CID 167041254

IUPACN-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide
SMILESO=CC1CCN(c2cnc(C(=O)NC3CCCCC3)cn2)CC1
InChIInChI=1S/C17H24N4O2/c22-12-13-6-8-21(9-7-13)16-11-18-15(10-19-16)17(23)20-14-4-2-1-3-5-14/h10-14H,1-9H2,(H,20,23)
InChIKeyKJGXWGHLHBRLNF-UHFFFAOYSA-N
MW316.40 g/mol
LogP1.95
Rot. Bonds4

About N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide

N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide (PubChem CID 167041254) has the molecular formula C17H24N4O2 and a molecular weight of 316.40 g/mol. Its IUPAC name is N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide
PubChem CID167041254
Molecular FormulaC17H24N4O2
Molecular Weight316.40 g/mol
Exact Mass316.19
IUPAC NameN-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide
SMILESO=CC1CCN(c2cnc(C(=O)NC3CCCCC3)cn2)CC1
InChIInChI=1S/C17H24N4O2/c22-12-13-6-8-21(9-7-13)16-11-18-15(10-19-16)17(23)20-14-4-2-1-3-5-14/h10-14H,1-9H2,(H,20,23)
InChIKeyKJGXWGHLHBRLNF-UHFFFAOYSA-N
XLogP1.95
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-cycloheptyl-5-(4-methylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109275249
N-cyclopropyl-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109271555
N-cyclopentyl-5-morpholin-4-ylpyrazine-2-carboxamide
CID 109273889
N-cyclohexyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109274695
5-(4-benzylpiperidin-1-yl)-N-cyclopentylpyrazine-2-carboxamide
CID 109273957
5-(cyclooctylcarbamoyl)pyrazine-2-carboxylic acid
CID 120684742
N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109274707
N-cyclopentyl-5-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazine-2-carboxamide
CID 109273939
ethyl 4-[(5-pyrrolidin-1-ylpyrazine-2-carbonyl)amino]piperidine-1-carboxylate
CID 109273745
5-amino-N-cyclooctylpyrazine-2-carboxamide
CID 113381836
N-cyclohexyl-5-(2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109274719
N-cycloheptyl-5-(3,4-dihydro-2H-quinolin-1-yl)pyrazine-2-carboxamide
CID 109287476

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide?
The IUPAC name of N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide (CID 167041254) is N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide is O=CC1CCN(c2cnc(C(=O)NC3CCCCC3)cn2)CC1.
What is the InChIKey of N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide?
The InChIKey is KJGXWGHLHBRLNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c22-12-13-6-8-21(9-7-13)16-11-18-15(10-19-16)17(23)20-14-4-2-1-3-5-14/h10-14H,1-9H2,(H,20,23).
What are the key properties of N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide?
N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide has a molecular weight of 316.40 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-(4-formylpiperidin-1-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 167041254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).