N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide

C19H31N5O2 — CID 69353749

IUPACN-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide
SMILESCNC(=O)c1cnc(N2CCC(OC3CCN(C(C)C)CC3)CC2)cn1
InChIInChI=1S/C19H31N5O2/c1-14(2)23-8-4-15(5-9-23)26-16-6-10-24(11-7-16)18-13-21-17(12-22-18)19(25)20-3/h12-16H,4-11H2,1-3H3,(H,20,25)
InChIKeySBAJKGNKECHQLO-UHFFFAOYSA-N
MW361.49 g/mol
LogP1.69
Rot. Bonds5

About N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide

N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide (PubChem CID 69353749) has the molecular formula C19H31N5O2 and a molecular weight of 361.49 g/mol. Its IUPAC name is N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide
PubChem CID69353749
Molecular FormulaC19H31N5O2
Molecular Weight361.49 g/mol
Exact Mass361.25
IUPAC NameN-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide
SMILESCNC(=O)c1cnc(N2CCC(OC3CCN(C(C)C)CC3)CC2)cn1
InChIInChI=1S/C19H31N5O2/c1-14(2)23-8-4-15(5-9-23)26-16-6-10-24(11-7-16)18-13-21-17(12-22-18)19(25)20-3/h12-16H,4-11H2,1-3H3,(H,20,25)
InChIKeySBAJKGNKECHQLO-UHFFFAOYSA-N
XLogP1.69
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.49
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide?
The IUPAC name of N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide (CID 69353749) is N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide is CNC(=O)c1cnc(N2CCC(OC3CCN(C(C)C)CC3)CC2)cn1.
What is the InChIKey of N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide?
The InChIKey is SBAJKGNKECHQLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N5O2/c1-14(2)23-8-4-15(5-9-23)26-16-6-10-24(11-7-16)18-13-21-17(12-22-18)19(25)20-3/h12-16H,4-11H2,1-3H3,(H,20,25).
What are the key properties of N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide?
N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide has a molecular weight of 361.49 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 69353749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).