1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one

C10H13N3O2 — CID 168664121

IUPAC1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
SMILESNc1cccc(N2CC(CO)CC2=O)n1
InChIInChI=1S/C10H13N3O2/c11-8-2-1-3-9(12-8)13-5-7(6-14)4-10(13)15/h1-3,7,14H,4-6H2,(H2,11,12)
InChIKeyJUEHWZDQRBFHBI-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.01
Rot. Bonds2

About 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one

1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one (PubChem CID 168664121) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
PubChem CID168664121
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
SMILESNc1cccc(N2CC(CO)CC2=O)n1
InChIInChI=1S/C10H13N3O2/c11-8-2-1-3-9(12-8)13-5-7(6-14)4-10(13)15/h1-3,7,14H,4-6H2,(H2,11,12)
InChIKeyJUEHWZDQRBFHBI-UHFFFAOYSA-N
XLogP0.01
TPSA79.45 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 ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(hydroxymethyl)-1-(5-iodo-6-methyl-2-pyridinyl)pyrrolidin-2-one
CID 168662716
4-(hydroxymethyl)-1-[5-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one
CID 168664287
1-(4-chloro-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168664302
6-[(4R)-4-(hydroxymethyl)-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one
CID 161063969
4-(hydroxymethyl)-1-pyridazin-4-ylpyrrolidin-2-one
CID 168664190
4-(hydroxymethyl)-1-[3-(hydroxymethyl)phenyl]pyrrolidin-2-one
CID 168664094
methyl 6-[4-(hydroxymethyl)-2-oxopyrrolidin-1-yl]pyridine-3-carboxylate
CID 168662305
4-(hydroxymethyl)-1-(4-phenylphenyl)pyrrolidin-2-one
CID 168663566
6-[4-(hydroxymethyl)-2-oxopyrrolidin-1-yl]pyridine-3-carbonitrile
CID 168663615
4-amino-2-bromo-6-[4-(hydroxymethyl)-2-oxopyrrolidin-1-yl]pyridine-3-carbonitrile
CID 168663422
1-[5-(2-fluorophenyl)-2-pyridinyl]-4-(hydroxymethyl)pyrrolidin-2-one
CID 141116621
1-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4-(hydroxymethyl)pyrrolidin-2-one
CID 168663927

Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one?
The IUPAC name of 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one (CID 168664121) is 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one?
The canonical SMILES for 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one is Nc1cccc(N2CC(CO)CC2=O)n1.
What is the InChIKey of 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one?
The InChIKey is JUEHWZDQRBFHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c11-8-2-1-3-9(12-8)13-5-7(6-14)4-10(13)15/h1-3,7,14H,4-6H2,(H2,11,12).
What are the key properties of 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one?
1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one has a molecular weight of 207.23 g/mol, XLogP of 0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one is sourced from PubChem (CID 168664121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).