4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide

C18H29N5O2 — CID 154803349

IUPAC4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide
SMILESCCN(C(=O)N1CCC(C(=O)N2CCn3cncc3C2)CC1)C(C)C
InChIInChI=1S/C18H29N5O2/c1-4-23(14(2)3)18(25)20-7-5-15(6-8-20)17(24)21-9-10-22-13-19-11-16(22)12-21/h11,13-15H,4-10,12H2,1-3H3
InChIKeyPWHIJKHPLRORHW-UHFFFAOYSA-N
MW347.46 g/mol
LogP1.79
Rot. Bonds3

About 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide

4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide (PubChem CID 154803349) has the molecular formula C18H29N5O2 and a molecular weight of 347.46 g/mol. Its IUPAC name is 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide
PubChem CID154803349
Molecular FormulaC18H29N5O2
Molecular Weight347.46 g/mol
Exact Mass347.23
IUPAC Name4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide
SMILESCCN(C(=O)N1CCC(C(=O)N2CCn3cncc3C2)CC1)C(C)C
InChIInChI=1S/C18H29N5O2/c1-4-23(14(2)3)18(25)20-7-5-15(6-8-20)17(24)21-9-10-22-13-19-11-16(22)12-21/h11,13-15H,4-10,12H2,1-3H3
InChIKeyPWHIJKHPLRORHW-UHFFFAOYSA-N
XLogP1.79
TPSA61.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide?
The IUPAC name of 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide (CID 154803349) is 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide?
The canonical SMILES for 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide is CCN(C(=O)N1CCC(C(=O)N2CCn3cncc3C2)CC1)C(C)C.
What is the InChIKey of 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide?
The InChIKey is PWHIJKHPLRORHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N5O2/c1-4-23(14(2)3)18(25)20-7-5-15(6-8-20)17(24)21-9-10-22-13-19-11-16(22)12-21/h11,13-15H,4-10,12H2,1-3H3.
What are the key properties of 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide?
4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide has a molecular weight of 347.46 g/mol, XLogP of 1.79, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-N-ethyl-N-propan-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 154803349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).