(4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone

C14H19N5O — CID 62081428

IUPAC(4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
SMILESCc1[nH]nc(C(=O)N2CCn3c(C)ccc3C2C)c1N
InChIInChI=1S/C14H19N5O/c1-8-4-5-11-10(3)19(7-6-18(8)11)14(20)13-12(15)9(2)16-17-13/h4-5,10H,6-7,15H2,1-3H3,(H,16,17)
InChIKeyLKJULAAABCHYCU-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.63
Rot. Bonds1

About (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone

(4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone (PubChem CID 62081428) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone.

Molecular Properties

Compound Name(4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
PubChem CID62081428
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name(4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
SMILESCc1[nH]nc(C(=O)N2CCn3c(C)ccc3C2C)c1N
InChIInChI=1S/C14H19N5O/c1-8-4-5-11-10(3)19(7-6-18(8)11)14(20)13-12(15)9(2)16-17-13/h4-5,10H,6-7,15H2,1-3H3,(H,16,17)
InChIKeyLKJULAAABCHYCU-UHFFFAOYSA-N
XLogP1.63
TPSA79.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone with MolForge

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Launch Full Analysis

Related Compounds

(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-(2H-triazol-4-yl)methanone
CID 79806177
(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-phenylmethanone
CID 60628235
(2-chloro-3-pyridinyl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
CID 60628232
(2-amino-4-chlorophenyl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
CID 61115025
(2S)-2-amino-1-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)propan-1-one
CID 61147289
1-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-methoxyethanone
CID 60724893
[1-(2-aminoethyl)imidazol-4-yl]-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
CID 107496866
6-amino-1-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)hexan-1-one
CID 54869090
1-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)butan-1-one
CID 60628219
1-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pentane-1,4-dione
CID 65417599
(4-amino-5-methyl-1H-pyrazol-3-yl)-(3-methylpyrrolidin-1-yl)methanone
CID 62081954
(4-amino-5-methyl-1H-pyrazol-3-yl)-pyrrolidin-1-ylmethanone
CID 62083322

Frequently Asked Questions

What is the IUPAC name of (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone?
The IUPAC name of (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone (CID 62081428) is (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone.
What is the SMILES notation for (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone?
The canonical SMILES for (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone is Cc1[nH]nc(C(=O)N2CCn3c(C)ccc3C2C)c1N.
What is the InChIKey of (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone?
The InChIKey is LKJULAAABCHYCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-8-4-5-11-10(3)19(7-6-18(8)11)14(20)13-12(15)9(2)16-17-13/h4-5,10H,6-7,15H2,1-3H3,(H,16,17).
What are the key properties of (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone?
(4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone has a molecular weight of 273.34 g/mol, XLogP of 1.63, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-5-methyl-1H-pyrazol-3-yl)-(1,6-dimethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone is sourced from PubChem (CID 62081428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).