2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide

C10H13N3O2 — CID 121352227

IUPAC2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide
SMILESNc1cc(C(=O)N[C@H]2CCOC2)ccn1
InChIInChI=1S/C10H13N3O2/c11-9-5-7(1-3-12-9)10(14)13-8-2-4-15-6-8/h1,3,5,8H,2,4,6H2,(H2,11,12)(H,13,14)/t8-/m0/s1
InChIKeyWMFRWNUYIVUOCU-QMMMGPOBSA-N
MW207.23 g/mol
LogP0.18
Rot. Bonds2

About 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide

2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide (PubChem CID 121352227) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide
PubChem CID121352227
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide
SMILESNc1cc(C(=O)N[C@H]2CCOC2)ccn1
InChIInChI=1S/C10H13N3O2/c11-9-5-7(1-3-12-9)10(14)13-8-2-4-15-6-8/h1,3,5,8H,2,4,6H2,(H2,11,12)(H,13,14)/t8-/m0/s1
InChIKeyWMFRWNUYIVUOCU-QMMMGPOBSA-N
XLogP0.18
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(oxolan-3-yl)pyridine-4-carboxamide
CID 139360784
2-amino-N-cyclopentylpyridine-4-carboxamide
CID 62154850
2-amino-N-(3-methylcyclohexyl)pyridine-4-carboxamide
CID 55042070
2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide
CID 62161092
N-(oxolan-3-yl)-3-sulfamoylbenzamide
CID 80712621
2-amino-N-(4-propylcyclohexyl)pyridine-4-carboxamide
CID 55042146
N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 80712536
2-amino-6-chloro-N-(oxan-3-yl)pyridine-4-carboxamide
CID 55190561
N-(oxolan-3-yl)furan-3-carboxamide
CID 130743970
4-hydroxy-N-(oxolan-3-yl)benzamide
CID 80713158
2-amino-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 64667254
N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide
CID 63362128

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide (CID 121352227) is 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide is Nc1cc(C(=O)N[C@H]2CCOC2)ccn1.
What is the InChIKey of 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide?
The InChIKey is WMFRWNUYIVUOCU-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H13N3O2/c11-9-5-7(1-3-12-9)10(14)13-8-2-4-15-6-8/h1,3,5,8H,2,4,6H2,(H2,11,12)(H,13,14)/t8-/m0/s1.
What are the key properties of 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide?
2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide has a molecular weight of 207.23 g/mol, XLogP of 0.18, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide is sourced from PubChem (CID 121352227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).