N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide

C11H15N3O2 — CID 81331226

IUPACN-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide
SMILESCC1CCC(C(=O)Nc2ccc(N)nc2)O1
InChIInChI=1S/C11H15N3O2/c1-7-2-4-9(16-7)11(15)14-8-3-5-10(12)13-6-8/h3,5-7,9H,2,4H2,1H3,(H2,12,13)(H,14,15)
InChIKeyNWTUQLFEUZPYRV-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.17
Rot. Bonds2

About N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide

N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide (PubChem CID 81331226) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide
PubChem CID81331226
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide
SMILESCC1CCC(C(=O)Nc2ccc(N)nc2)O1
InChIInChI=1S/C11H15N3O2/c1-7-2-4-9(16-7)11(15)14-8-3-5-10(12)13-6-8/h3,5-7,9H,2,4H2,1H3,(H2,12,13)(H,14,15)
InChIKeyNWTUQLFEUZPYRV-UHFFFAOYSA-N
XLogP1.17
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,5R)-N-[6-(hydroxymethyl)-3-pyridinyl]-5-methyloxolane-2-carboxamide
CID 166159129
N-(6-amino-3-pyridinyl)-3-(5-methyloxolan-2-yl)propanamide;hydrochloride
CID 119515981
(2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide
CID 166159062
N-(6-amino-3-pyridinyl)-4-methylcyclohexane-1-carboxamide
CID 81478295
N-[6-(1,2-dihydroxyethyl)-3-pyridinyl]-5-methyloxolane-2-carboxamide
CID 166158897
N-(4-bromophenyl)-5-methyloxolane-2-carboxamide
CID 80949197
5-methyl-N-[6-[[(3S)-oxolan-3-yl]methyl]-3-pyridinyl]oxolane-2-carboxamide
CID 166161188
N-[4-(bromomethyl)phenyl]-5-methyloxolane-2-carboxamide
CID 114310972
N-(6-amino-3-pyridinyl)oxane-4-carboxamide;hydrochloride
CID 119514919
(5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 167211610
N-(2,3-dihydrofuro[3,2-b]pyridin-6-yl)-5-methyloxolane-2-carboxamide
CID 166160378
5-methyl-N-[2-(methylaminomethyl)-4-pyridinyl]oxolane-2-carboxamide
CID 166160576

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide (CID 81331226) is N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide is CC1CCC(C(=O)Nc2ccc(N)nc2)O1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide?
The InChIKey is NWTUQLFEUZPYRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-7-2-4-9(16-7)11(15)14-8-3-5-10(12)13-6-8/h3,5-7,9H,2,4H2,1H3,(H2,12,13)(H,14,15).
What are the key properties of N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide?
N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide is sourced from PubChem (CID 81331226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).