N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide

C9H12N4O — CID 127017038

IUPACN-(azetidin-3-ylmethyl)pyrazine-2-carboxamide
SMILESO=C(NCC1CNC1)c1cnccn1
InChIInChI=1S/C9H12N4O/c14-9(8-6-10-1-2-12-8)13-5-7-3-11-4-7/h1-2,6-7,11H,3-5H2,(H,13,14)
InChIKeyHKIJDWGUEWMDNB-UHFFFAOYSA-N
MW192.22 g/mol
LogP-0.57
Rot. Bonds3

About N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide

N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide (PubChem CID 127017038) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(azetidin-3-ylmethyl)pyrazine-2-carboxamide
PubChem CID127017038
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC NameN-(azetidin-3-ylmethyl)pyrazine-2-carboxamide
SMILESO=C(NCC1CNC1)c1cnccn1
InChIInChI=1S/C9H12N4O/c14-9(8-6-10-1-2-12-8)13-5-7-3-11-4-7/h1-2,6-7,11H,3-5H2,(H,13,14)
InChIKeyHKIJDWGUEWMDNB-UHFFFAOYSA-N
XLogP-0.57
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6,7,8,9-tetrahydro-5H-imidazo[1,2-a][1,4]diazepin-6-ylmethyl)pyrazine-2-carboxamide
CID 121229452
4-[(pyrazine-2-carbonylamino)methyl]piperidine-1-carboxylic acid
CID 154500129
N-(2-hydroxyethyl)pyrazine-2-carboxamide
CID 14230272
N-(3,4-dihydro-2H-chromen-3-ylmethyl)pyrazine-2-carboxamide
CID 47115544
N-[[(3S)-1-phenylpyrrolidin-3-yl]methyl]pyrazine-2-carboxamide
CID 35220191
N-[10-(pyrazine-2-carbonylamino)decyl]pyrazine-2-carboxamide
CID 71517100
N-[[(3R,4R)-3,4-dihydroxypiperidin-4-yl]methyl]pyrazine-2-carboxamide
CID 110133410
N-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidin-3-yl]methyl]pyrazine-2-carboxamide
CID 95228903
N-(2-amino-2-oxoethyl)pyrazine-2-carboxamide
CID 14101204
N-(2-piperidin-4-yloxyethyl)pyrazine-2-carboxamide
CID 55251519
N-[[1-(2-methyl-4-pyridinyl)piperidin-4-yl]methyl]pyrazine-2-carboxamide
CID 131927095
N-(2,2-dimethylpropyl)pyrazine-2-carboxamide
CID 21060489

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide?
The IUPAC name of N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide (CID 127017038) is N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide is O=C(NCC1CNC1)c1cnccn1.
What is the InChIKey of N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide?
The InChIKey is HKIJDWGUEWMDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c14-9(8-6-10-1-2-12-8)13-5-7-3-11-4-7/h1-2,6-7,11H,3-5H2,(H,13,14).
What are the key properties of N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide?
N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide has a molecular weight of 192.22 g/mol, XLogP of -0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 127017038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).