6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide

C12H18N4O — CID 114101902

IUPAC6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide
SMILESCCCC1(CNC(=O)c2cncc(N)n2)CC1
InChIInChI=1S/C12H18N4O/c1-2-3-12(4-5-12)8-15-11(17)9-6-14-7-10(13)16-9/h6-7H,2-5,8H2,1H3,(H2,13,16)(H,15,17)
InChIKeyBPJWUMJNFLQQIN-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.37
Rot. Bonds5

About 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide

6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide (PubChem CID 114101902) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide
PubChem CID114101902
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide
SMILESCCCC1(CNC(=O)c2cncc(N)n2)CC1
InChIInChI=1S/C12H18N4O/c1-2-3-12(4-5-12)8-15-11(17)9-6-14-7-10(13)16-9/h6-7H,2-5,8H2,1H3,(H2,13,16)(H,15,17)
InChIKeyBPJWUMJNFLQQIN-UHFFFAOYSA-N
XLogP1.37
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-[(1-ethylcyclopentyl)methyl]pyrazine-2-carboxamide
CID 114126499
6-amino-N-[(2-methylthiolan-2-yl)methyl]pyrazine-2-carboxamide
CID 114036016
6-amino-N-[(2-methyloxolan-2-yl)methyl]pyrazine-2-carboxamide
CID 114036007
2-amino-6-methyl-N-[(1-propylcyclopropyl)methyl]pyridine-4-carboxamide
CID 114101909
6-amino-N-[(1-ethylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride
CID 119999117
4-amino-N-[(1-propylcyclopropyl)methyl]benzamide
CID 103813045
5-amino-1-methyl-N-[(1-propylcyclopropyl)methyl]pyrazole-4-carboxamide
CID 104591802
6-amino-N-(4,4-dimethylcyclohexyl)pyrazine-2-carboxamide
CID 114035957
6-amino-N-[2-[cyclopropyl(ethyl)amino]ethyl]pyrazine-2-carboxamide
CID 114134895
5-cyano-N-[(1-propylcyclopropyl)methyl]pyridine-2-carboxamide
CID 103762122
6-methyl-N-propylpyrazine-2-carboxamide
CID 54299010
N-[(1-propylcyclopropyl)methyl]benzamide
CID 103762150

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide?
The IUPAC name of 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide (CID 114101902) is 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide.
What is the SMILES notation for 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide?
The canonical SMILES for 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide is CCCC1(CNC(=O)c2cncc(N)n2)CC1.
What is the InChIKey of 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide?
The InChIKey is BPJWUMJNFLQQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-2-3-12(4-5-12)8-15-11(17)9-6-14-7-10(13)16-9/h6-7H,2-5,8H2,1H3,(H2,13,16)(H,15,17).
What are the key properties of 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide?
6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide is sourced from PubChem (CID 114101902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).