6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide

C11H16N4O2 — CID 133496605

IUPAC6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide
SMILESNC(=O)c1cncc(NCC2(CCO)CC2)n1
InChIInChI=1S/C11H16N4O2/c12-10(17)8-5-13-6-9(15-8)14-7-11(1-2-11)3-4-16/h5-6,16H,1-4,7H2,(H2,12,17)(H,14,15)
InChIKeyZTLMAQUUKRKSFN-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.15
Rot. Bonds6

About 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide

6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide (PubChem CID 133496605) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide
PubChem CID133496605
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide
SMILESNC(=O)c1cncc(NCC2(CCO)CC2)n1
InChIInChI=1S/C11H16N4O2/c12-10(17)8-5-13-6-9(15-8)14-7-11(1-2-11)3-4-16/h5-6,16H,1-4,7H2,(H2,12,17)(H,14,15)
InChIKeyZTLMAQUUKRKSFN-UHFFFAOYSA-N
XLogP0.15
TPSA101.13 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide?
The IUPAC name of 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide (CID 133496605) is 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide.
What is the SMILES notation for 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide?
The canonical SMILES for 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide is NC(=O)c1cncc(NCC2(CCO)CC2)n1.
What is the InChIKey of 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide?
The InChIKey is ZTLMAQUUKRKSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c12-10(17)8-5-13-6-9(15-8)14-7-11(1-2-11)3-4-16/h5-6,16H,1-4,7H2,(H2,12,17)(H,14,15).
What are the key properties of 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide?
6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 0.15, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide is sourced from PubChem (CID 133496605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).