2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

C15H19N5O2 — CID 53389820

IUPAC2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide
SMILESC[C@@H](NC(=O)c1c[nH]c2ncc(C3CC3)nc12)C(=O)N(C)C
InChIInChI=1S/C15H19N5O2/c1-8(15(22)20(2)3)18-14(21)10-6-16-13-12(10)19-11(7-17-13)9-4-5-9/h6-9H,4-5H2,1-3H3,(H,16,17)(H,18,21)/t8-/m1/s1
InChIKeyUCYRVSPHWUSSEB-MRVPVSSYSA-N
MW301.35 g/mol
LogP1.04
Rot. Bonds4

About 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide (PubChem CID 53389820) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide
PubChem CID53389820
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC Name2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide
SMILESC[C@@H](NC(=O)c1c[nH]c2ncc(C3CC3)nc12)C(=O)N(C)C
InChIInChI=1S/C15H19N5O2/c1-8(15(22)20(2)3)18-14(21)10-6-16-13-12(10)19-11(7-17-13)9-4-5-9/h6-9H,4-5H2,1-3H3,(H,16,17)(H,18,21)/t8-/m1/s1
InChIKeyUCYRVSPHWUSSEB-MRVPVSSYSA-N
XLogP1.04
TPSA90.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide?
The IUPAC name of 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide (CID 53389820) is 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide is C[C@@H](NC(=O)c1c[nH]c2ncc(C3CC3)nc12)C(=O)N(C)C.
What is the InChIKey of 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide?
The InChIKey is UCYRVSPHWUSSEB-MRVPVSSYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-8(15(22)20(2)3)18-14(21)10-6-16-13-12(10)19-11(7-17-13)9-4-5-9/h6-9H,4-5H2,1-3H3,(H,16,17)(H,18,21)/t8-/m1/s1.
What are the key properties of 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide?
2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 1.04, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide is sourced from PubChem (CID 53389820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).