4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide

C12H17N3O2 — CID 66266558

IUPAC4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)NCc1ccccn1
InChIInChI=1S/C12H17N3O2/c1-13-11-8-17-7-10(11)12(16)15-6-9-4-2-3-5-14-9/h2-5,10-11,13H,6-8H2,1H3,(H,15,16)
InChIKeySYKLEMNEWCVIIS-UHFFFAOYSA-N
MW235.29 g/mol
LogP-0.07
Rot. Bonds4

About 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide

4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide (PubChem CID 66266558) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide
PubChem CID66266558
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)NCc1ccccn1
InChIInChI=1S/C12H17N3O2/c1-13-11-8-17-7-10(11)12(16)15-6-9-4-2-3-5-14-9/h2-5,10-11,13H,6-8H2,1H3,(H,15,16)
InChIKeySYKLEMNEWCVIIS-UHFFFAOYSA-N
XLogP-0.07
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(methylamino)-N-(2-pyridin-2-ylethyl)oxolane-3-carboxamide
CID 66265963
N-methyl-4-(methylamino)-N-(2-pyridin-2-ylethyl)oxolane-3-carboxamide
CID 66267541
4-(methylamino)-N-(1,2-oxazol-5-ylmethyl)oxolane-3-carboxamide
CID 106417047
N-(1,3-benzothiazol-2-ylmethyl)-4-(methylamino)oxolane-3-carboxamide
CID 66266629
N-[(6-methoxy-3-pyridinyl)methyl]-4-(methylamino)oxolane-3-carboxamide
CID 66267416
cis-(1R,2S)-2-(pyridin-2-ylmethylcarbamoyl)cyclohexane-1-carboxylate
CID 6949299
(3aS,7S,7aS)-2-cyclopentyl-N-(pyridin-2-ylmethyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrole-7-carboxamide
CID 124781108
5-oxo-N-(pyridin-2-ylmethyl)morpholine-3-carboxamide
CID 110696717
(1S,2R,4S)-N-(pyridin-2-ylmethyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 7471796
N-[(2,5-difluorophenyl)methyl]-4-(methylamino)oxolane-3-carboxamide
CID 66266257
4-(ethylamino)-N-[(3-methyl-2-pyridinyl)methyl]oxolane-3-carboxamide
CID 66257562
1-methyl-5-oxo-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide
CID 110687259

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide?
The IUPAC name of 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide (CID 66266558) is 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide.
What is the SMILES notation for 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide?
The canonical SMILES for 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide is CNC1COCC1C(=O)NCc1ccccn1.
What is the InChIKey of 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide?
The InChIKey is SYKLEMNEWCVIIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-13-11-8-17-7-10(11)12(16)15-6-9-4-2-3-5-14-9/h2-5,10-11,13H,6-8H2,1H3,(H,15,16).
What are the key properties of 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide?
4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide has a molecular weight of 235.29 g/mol, XLogP of -0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-(pyridin-2-ylmethyl)oxolane-3-carboxamide is sourced from PubChem (CID 66266558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).