N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide

C16H26N4O — CID 107375429

IUPACN-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide
SMILESCCNc1cnc(C(=O)NC(CC)C2CCCCC2)cn1
InChIInChI=1S/C16H26N4O/c1-3-13(12-8-6-5-7-9-12)20-16(21)14-10-19-15(11-18-14)17-4-2/h10-13H,3-9H2,1-2H3,(H,17,19)(H,20,21)
InChIKeyIQWODSRNORBDSG-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.00
Rot. Bonds6

About N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide

N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide (PubChem CID 107375429) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide
PubChem CID107375429
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide
SMILESCCNc1cnc(C(=O)NC(CC)C2CCCCC2)cn1
InChIInChI=1S/C16H26N4O/c1-3-13(12-8-6-5-7-9-12)20-16(21)14-10-19-15(11-18-14)17-4-2/h10-13H,3-9H2,1-2H3,(H,17,19)(H,20,21)
InChIKeyIQWODSRNORBDSG-UHFFFAOYSA-N
XLogP3.00
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide (CID 107375429) is N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide is CCNc1cnc(C(=O)NC(CC)C2CCCCC2)cn1.
What is the InChIKey of N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide?
The InChIKey is IQWODSRNORBDSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-3-13(12-8-6-5-7-9-12)20-16(21)14-10-19-15(11-18-14)17-4-2/h10-13H,3-9H2,1-2H3,(H,17,19)(H,20,21).
What are the key properties of N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide?
N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 3.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpropyl)-5-(ethylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 107375429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).