3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one

C10H14N2O2 — CID 137450543

IUPAC3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one
SMILESCO[C@H]1CC[C@@H]1n1cccc(N)c1=O
InChIInChI=1S/C10H14N2O2/c1-14-9-5-4-8(9)12-6-2-3-7(11)10(12)13/h2-3,6,8-9H,4-5,11H2,1H3/t8-,9-/m0/s1
InChIKeyURPYYTQGXQMNLK-IUCAKERBSA-N
MW194.23 g/mol
LogP0.78
Rot. Bonds2

About 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one

3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one (PubChem CID 137450543) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one
PubChem CID137450543
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one
SMILESCO[C@H]1CC[C@@H]1n1cccc(N)c1=O
InChIInChI=1S/C10H14N2O2/c1-14-9-5-4-8(9)12-6-2-3-7(11)10(12)13/h2-3,6,8-9H,4-5,11H2,1H3/t8-,9-/m0/s1
InChIKeyURPYYTQGXQMNLK-IUCAKERBSA-N
XLogP0.78
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Amino-1-(2-methoxyethyl)pyridin-2(1H)-one
CID 62102773
(R)-3-Amino-1-(tetrahydro-2H-pyran-3-yl)pyridin-2(1H)-one
CID 137441431
3-Amino-1-(oxan-3-yl)-1,2-dihydropyridin-2-one
CID 137441433
(S)-3-Amino-1-(tetrahydro-2H-pyran-3-yl)pyridin-2(1H)-one
CID 137441550
1-[(1S,2S)-2-methoxycyclobutyl]-3-(propan-2-ylamino)pyridin-2-one
CID 137449043
1-[(1R,2R)-2-methoxycyclobutyl]-3-(propan-2-ylamino)pyridin-2-one
CID 137449063
1-[(1S,2S)-2-hydroxycyclobutyl]-3-(methylamino)pyridin-2-one
CID 137449073
1-[(1R,2R)-2-hydroxycyclobutyl]-3-(methylamino)pyridin-2-one
CID 137449076
1-[(1S,2R)-2-hydroxycyclobutyl]-3-(methylamino)pyridin-2-one
CID 137449428
1-(2-Methoxycyclopropyl)-3-(methylamino)pyridin-2-one
CID 137449558
1-[(1R,2R)-2-methoxycyclopropyl]-3-(methylamino)pyridin-2-one
CID 137449559
1-[(1S,2S)-2-methoxycyclopropyl]-3-(methylamino)pyridin-2-one
CID 137449567

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one?
The IUPAC name of 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one (CID 137450543) is 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one.
What is the SMILES notation for 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one?
The canonical SMILES for 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one is CO[C@H]1CC[C@@H]1n1cccc(N)c1=O.
What is the InChIKey of 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one?
The InChIKey is URPYYTQGXQMNLK-IUCAKERBSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-14-9-5-4-8(9)12-6-2-3-7(11)10(12)13/h2-3,6,8-9H,4-5,11H2,1H3/t8-,9-/m0/s1.
What are the key properties of 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one?
3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one has a molecular weight of 194.23 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-[(1S,2S)-2-methoxycyclobutyl]pyridin-2-one is sourced from PubChem (CID 137450543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).