N-(oxetan-3-yl)pyridine-3-carboxamide

C9H10N2O2 — CID 66910448

IUPACN-(oxetan-3-yl)pyridine-3-carboxamide
SMILESO=C(NC1COC1)c1cccnc1
InChIInChI=1S/C9H10N2O2/c12-9(11-8-5-13-6-8)7-2-1-3-10-4-7/h1-4,8H,5-6H2,(H,11,12)
InChIKeyMWQQKEWXUGIJFU-UHFFFAOYSA-N
MW178.19 g/mol
LogP0.21
Rot. Bonds2

About N-(oxetan-3-yl)pyridine-3-carboxamide

N-(oxetan-3-yl)pyridine-3-carboxamide (PubChem CID 66910448) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is N-(oxetan-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(oxetan-3-yl)pyridine-3-carboxamide
PubChem CID66910448
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC NameN-(oxetan-3-yl)pyridine-3-carboxamide
SMILESO=C(NC1COC1)c1cccnc1
InChIInChI=1S/C9H10N2O2/c12-9(11-8-5-13-6-8)7-2-1-3-10-4-7/h1-4,8H,5-6H2,(H,11,12)
InChIKeyMWQQKEWXUGIJFU-UHFFFAOYSA-N
XLogP0.21
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentylpyridine-3-carboxamide
CID 805532
N-(3,4-dihydro-2H-chromen-3-yl)pyridine-3-carboxamide
CID 110751511
N-(4-ethylcyclohexyl)pyridine-3-carboxamide
CID 25237064
N-[(4S)-2-oxoazepan-4-yl]pyridine-3-carboxamide
CID 18648131
N-[(1S,5S)-8-methylsulfonyl-8-azabicyclo[3.2.1]octan-3-yl]pyridine-3-carboxamide
CID 99987360
phenyl 4-(pyridine-3-carbonylamino)piperidine-1-carboxylate
CID 110821885
N-[(1R,5R)-3,3,5-trimethylcyclohexyl]pyridine-3-carboxamide
CID 39358749
N-(1-methylsulfonylpiperidin-4-yl)pyridine-3-carboxamide
CID 3218770
N-[4-(imidazole-1-carbonylamino)cyclohexyl]pyridine-3-carboxamide
CID 70020378
N-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 175209394
N-(2-methylcyclohexyl)pyridine-3-carboxamide
CID 11841361
N-methylpyridine-3-carboxamide chloride
CID 20976730

Frequently Asked Questions

What is the IUPAC name of N-(oxetan-3-yl)pyridine-3-carboxamide?
The IUPAC name of N-(oxetan-3-yl)pyridine-3-carboxamide (CID 66910448) is N-(oxetan-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(oxetan-3-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(oxetan-3-yl)pyridine-3-carboxamide is O=C(NC1COC1)c1cccnc1.
What is the InChIKey of N-(oxetan-3-yl)pyridine-3-carboxamide?
The InChIKey is MWQQKEWXUGIJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2/c12-9(11-8-5-13-6-8)7-2-1-3-10-4-7/h1-4,8H,5-6H2,(H,11,12).
What are the key properties of N-(oxetan-3-yl)pyridine-3-carboxamide?
N-(oxetan-3-yl)pyridine-3-carboxamide has a molecular weight of 178.19 g/mol, XLogP of 0.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxetan-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 66910448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).