N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

C14H17N5O — CID 138027961

IUPACN-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
SMILESCCc1ncc(NC(=O)N2CCn3cccc3C2)cn1
InChIInChI=1S/C14H17N5O/c1-2-13-15-8-11(9-16-13)17-14(20)19-7-6-18-5-3-4-12(18)10-19/h3-5,8-9H,2,6-7,10H2,1H3,(H,17,20)
InChIKeyKSJGVDFDGSLYCF-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.89
Rot. Bonds2

About N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide (PubChem CID 138027961) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
PubChem CID138027961
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC NameN-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
SMILESCCc1ncc(NC(=O)N2CCn3cccc3C2)cn1
InChIInChI=1S/C14H17N5O/c1-2-13-15-8-11(9-16-13)17-14(20)19-7-6-18-5-3-4-12(18)10-19/h3-5,8-9H,2,6-7,10H2,1H3,(H,17,20)
InChIKeyKSJGVDFDGSLYCF-UHFFFAOYSA-N
XLogP1.89
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
CID 110646809
3-(4-cyclopropyl-1,2,4-triazol-3-yl)-N-(2-ethylpyrimidin-5-yl)piperidine-1-carboxamide
CID 75502081
2-(7-chloro-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-ethylpyrimidin-5-yl)-2-oxoacetamide
CID 97248088
N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
CID 119065350
(2S)-N-(2-ethylpyrimidin-5-yl)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholine-4-carboxamide
CID 129477494
N-(3-ethylphenyl)-4-(1-methylpyrazol-4-yl)-3-oxopiperazine-1-carboxamide
CID 71976492
2-cyclopentyl-N-(2-ethylpyrimidin-5-yl)pyrazole-3-carboxamide
CID 139011643
1-N,4-N-bis(4-methylphenyl)piperazine-1,4-dicarboxamide
CID 4055899
N-(2-cyclopropylpyrimidin-5-yl)-4-phenylpiperazine-1-carboxamide
CID 98430279
4-(3-ethyl-1,2,4-thiadiazol-5-yl)-N-pyridin-3-yl-1,4-diazepane-1-carboxamide
CID 71992611
4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 3370606
N-(4-ethylphenyl)-3-methyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene-10-carboxamide
CID 53140337

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide (CID 138027961) is N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide is CCc1ncc(NC(=O)N2CCn3cccc3C2)cn1.
What is the InChIKey of N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is KSJGVDFDGSLYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-2-13-15-8-11(9-16-13)17-14(20)19-7-6-18-5-3-4-12(18)10-19/h3-5,8-9H,2,6-7,10H2,1H3,(H,17,20).
What are the key properties of N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide?
N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylpyrimidin-5-yl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 138027961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).