5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one

C14H23N3O2 — CID 114948024

IUPAC5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one
SMILESCN(CCn1cc(N)ccc1=O)CC1(O)CCCC1
InChIInChI=1S/C14H23N3O2/c1-16(11-14(19)6-2-3-7-14)8-9-17-10-12(15)4-5-13(17)18/h4-5,10,19H,2-3,6-9,11,15H2,1H3
InChIKeyLWBNBDDABJAQAG-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.67
Rot. Bonds5

About 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one

5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one (PubChem CID 114948024) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one
PubChem CID114948024
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one
SMILESCN(CCn1cc(N)ccc1=O)CC1(O)CCCC1
InChIInChI=1S/C14H23N3O2/c1-16(11-14(19)6-2-3-7-14)8-9-17-10-12(15)4-5-13(17)18/h4-5,10,19H,2-3,6-9,11,15H2,1H3
InChIKeyLWBNBDDABJAQAG-UHFFFAOYSA-N
XLogP0.67
TPSA71.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one?
The IUPAC name of 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one (CID 114948024) is 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one.
What is the SMILES notation for 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one?
The canonical SMILES for 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one is CN(CCn1cc(N)ccc1=O)CC1(O)CCCC1.
What is the InChIKey of 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one?
The InChIKey is LWBNBDDABJAQAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-16(11-14(19)6-2-3-7-14)8-9-17-10-12(15)4-5-13(17)18/h4-5,10,19H,2-3,6-9,11,15H2,1H3.
What are the key properties of 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one?
5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one has a molecular weight of 265.36 g/mol, XLogP of 0.67, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-[2-[(1-hydroxycyclopentyl)methyl-methylamino]ethyl]pyridin-2-one is sourced from PubChem (CID 114948024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).