[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone

C19H17ClN4O — CID 163344454

IUPAC[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)N1CCC(c2ccc3cc(Cl)cnc3n2)CC1
InChIInChI=1S/C19H17ClN4O/c20-15-11-14-4-5-16(23-18(14)22-12-15)13-6-9-24(10-7-13)19(25)17-3-1-2-8-21-17/h1-5,8,11-13H,6-7,9-10H2
InChIKeyQWKBYPBFYLLABG-UHFFFAOYSA-N
MW352.83 g/mol
LogP3.70
Rot. Bonds2

About [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone

[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone (PubChem CID 163344454) has the molecular formula C19H17ClN4O and a molecular weight of 352.83 g/mol. Its IUPAC name is [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone.

Molecular Properties

Compound Name[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone
PubChem CID163344454
Molecular FormulaC19H17ClN4O
Molecular Weight352.83 g/mol
Exact Mass352.11
IUPAC Name[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)N1CCC(c2ccc3cc(Cl)cnc3n2)CC1
InChIInChI=1S/C19H17ClN4O/c20-15-11-14-4-5-16(23-18(14)22-12-15)13-6-9-24(10-7-13)19(25)17-3-1-2-8-21-17/h1-5,8,11-13H,6-7,9-10H2
InChIKeyQWKBYPBFYLLABG-UHFFFAOYSA-N
XLogP3.70
TPSA58.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.83
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyrimidin-4-ylmethanone
CID 163344506
[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
CID 155974863
[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-(2,2-dimethylcyclopropyl)methanone
CID 163348070
(1-methyltriazol-4-yl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155975295
(5-cyclopropyl-1,2-oxazol-3-yl)-[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155799037
[4-(6-cyclopropyl-1,8-naphthyridin-2-yl)piperidin-1-yl]-(1,5-dimethylpyrazol-3-yl)methanone
CID 163348563
3-[2-[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-2-oxoethyl]-6-cyclopropylpyrimidin-4-one
CID 163344965
6-chloro-2-(1-ethylsulfonylpiperidin-4-yl)-1,8-naphthyridine
CID 163344099
(2-methylpyrazol-3-yl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155975284
[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(2-phenyltriazol-4-yl)methanone
CID 155799572
[4-(6-cyclopropyl-1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-4-yl)methanone
CID 163348869
(3-fluoro-4-pyridinyl)-[4-(6-pyridin-4-yl-1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 163345283

Frequently Asked Questions

What is the IUPAC name of [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone?
The IUPAC name of [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone (CID 163344454) is [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone.
What is the SMILES notation for [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone?
The canonical SMILES for [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone is O=C(c1ccccn1)N1CCC(c2ccc3cc(Cl)cnc3n2)CC1.
What is the InChIKey of [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone?
The InChIKey is QWKBYPBFYLLABG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O/c20-15-11-14-4-5-16(23-18(14)22-12-15)13-6-9-24(10-7-13)19(25)17-3-1-2-8-21-17/h1-5,8,11-13H,6-7,9-10H2.
What are the key properties of [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone?
[4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone has a molecular weight of 352.83 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(6-chloro-1,8-naphthyridin-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone is sourced from PubChem (CID 163344454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).