N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

C19H25N5O2 — CID 119065350

IUPACN-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
SMILESO=C(NCC(c1cccnc1)N1CCOCC1)N1CCn2cccc2C1
InChIInChI=1S/C19H25N5O2/c25-19(24-8-7-22-6-2-4-17(22)15-24)21-14-18(16-3-1-5-20-13-16)23-9-11-26-12-10-23/h1-6,13,18H,7-12,14-15H2,(H,21,25)
InChIKeyIYCHMRSSEZPOLY-UHFFFAOYSA-N
MW355.44 g/mol
LogP1.48
Rot. Bonds4

About N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide (PubChem CID 119065350) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
PubChem CID119065350
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
SMILESO=C(NCC(c1cccnc1)N1CCOCC1)N1CCn2cccc2C1
InChIInChI=1S/C19H25N5O2/c25-19(24-8-7-22-6-2-4-17(22)15-24)21-14-18(16-3-1-5-20-13-16)23-9-11-26-12-10-23/h1-6,13,18H,7-12,14-15H2,(H,21,25)
InChIKeyIYCHMRSSEZPOLY-UHFFFAOYSA-N
XLogP1.48
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide (CID 119065350) is N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide is O=C(NCC(c1cccnc1)N1CCOCC1)N1CCn2cccc2C1.
What is the InChIKey of N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is IYCHMRSSEZPOLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c25-19(24-8-7-22-6-2-4-17(22)15-24)21-14-18(16-3-1-5-20-13-16)23-9-11-26-12-10-23/h1-6,13,18H,7-12,14-15H2,(H,21,25).
What are the key properties of N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide?
N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 119065350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).