5-chloro-1-cyclopropylpyridin-2-one

C8H8ClNO — CID 162400664

IUPAC5-chloro-1-cyclopropylpyridin-2-one
SMILESO=c1ccc(Cl)cn1C1CC1
InChIInChI=1S/C8H8ClNO/c9-6-1-4-8(11)10(5-6)7-2-3-7/h1,4-5,7H,2-3H2
InChIKeyZTDVXTONAPCKIB-UHFFFAOYSA-N
MW169.61 g/mol
LogP1.84
Rot. Bonds1

About 5-chloro-1-cyclopropylpyridin-2-one

5-chloro-1-cyclopropylpyridin-2-one (PubChem CID 162400664) has the molecular formula C8H8ClNO and a molecular weight of 169.61 g/mol. Its IUPAC name is 5-chloro-1-cyclopropylpyridin-2-one.

Molecular Properties

Compound Name5-chloro-1-cyclopropylpyridin-2-one
PubChem CID162400664
Molecular FormulaC8H8ClNO
Molecular Weight169.61 g/mol
Exact Mass169.03
IUPAC Name5-chloro-1-cyclopropylpyridin-2-one
SMILESO=c1ccc(Cl)cn1C1CC1
InChIInChI=1S/C8H8ClNO/c9-6-1-4-8(11)10(5-6)7-2-3-7/h1,4-5,7H,2-3H2
InChIKeyZTDVXTONAPCKIB-UHFFFAOYSA-N
XLogP1.84
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.61
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Cyclopropyl-5-fluoropyridin-2-one
CID 134960128
1-Cyclopropylpyridin-2-one
CID 66584408
1-Butan-2-yl-5-fluoropyridin-2-one
CID 68104903
1-[(1S,2R)-2-fluorocyclopropyl]pyridin-2-one
CID 176003181
1-[(1R,2S)-2-fluorocyclopropyl]pyridin-2-one
CID 176003230
1-[(2S)-but-3-en-2-yl]-5-chloropyridin-2-one
CID 146161643
1-Cyclopropyl-4-fluoropyridin-2(1H)-one
CID 121231659
6-Chloro-1-(3-fluoropropyl)pyridin-2-one
CID 130714965
1-(3-Chloropropyl)pyridin-2-one
CID 12704875
1-(Butan-2-yl)pyridin-2(1H)-one
CID 18724633
3-Chloro-1-propan-2-ylpyridin-2-one
CID 57640417
5-Chloro-1-propan-2-ylpyridin-2-one
CID 57640535

Frequently Asked Questions

What is the IUPAC name of 5-chloro-1-cyclopropylpyridin-2-one?
The IUPAC name of 5-chloro-1-cyclopropylpyridin-2-one (CID 162400664) is 5-chloro-1-cyclopropylpyridin-2-one.
What is the SMILES notation for 5-chloro-1-cyclopropylpyridin-2-one?
The canonical SMILES for 5-chloro-1-cyclopropylpyridin-2-one is O=c1ccc(Cl)cn1C1CC1.
What is the InChIKey of 5-chloro-1-cyclopropylpyridin-2-one?
The InChIKey is ZTDVXTONAPCKIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClNO/c9-6-1-4-8(11)10(5-6)7-2-3-7/h1,4-5,7H,2-3H2.
What are the key properties of 5-chloro-1-cyclopropylpyridin-2-one?
5-chloro-1-cyclopropylpyridin-2-one has a molecular weight of 169.61 g/mol, XLogP of 1.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-1-cyclopropylpyridin-2-one is sourced from PubChem (CID 162400664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).