N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide

C15H24N4O — CID 107374839

IUPACN-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)N(CCC)CC2CC2)cn1
InChIInChI=1S/C15H24N4O/c1-3-7-16-14-10-17-13(9-18-14)15(20)19(8-4-2)11-12-5-6-12/h9-10,12H,3-8,11H2,1-2H3,(H,16,18)
InChIKeyGYVCJUYSXUNONL-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.56
Rot. Bonds8

About N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide

N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide (PubChem CID 107374839) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide
PubChem CID107374839
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)N(CCC)CC2CC2)cn1
InChIInChI=1S/C15H24N4O/c1-3-7-16-14-10-17-13(9-18-14)15(20)19(8-4-2)11-12-5-6-12/h9-10,12H,3-8,11H2,1-2H3,(H,16,18)
InChIKeyGYVCJUYSXUNONL-UHFFFAOYSA-N
XLogP2.56
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide (CID 107374839) is N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide is CCCNc1cnc(C(=O)N(CCC)CC2CC2)cn1.
What is the InChIKey of N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide?
The InChIKey is GYVCJUYSXUNONL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-3-7-16-14-10-17-13(9-18-14)15(20)19(8-4-2)11-12-5-6-12/h9-10,12H,3-8,11H2,1-2H3,(H,16,18).
What are the key properties of N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide?
N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.56, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 107374839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).