[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone

C17H17N5O — CID 155981275

IUPAC[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
SMILESO=C(c1ccn[nH]1)N1CCC(c2ccc3cccnc3n2)CC1
InChIInChI=1S/C17H17N5O/c23-17(15-5-9-19-21-15)22-10-6-12(7-11-22)14-4-3-13-2-1-8-18-16(13)20-14/h1-5,8-9,12H,6-7,10-11H2,(H,19,21)
InChIKeyXGCNRFPRKWSCJA-UHFFFAOYSA-N
MW307.36 g/mol
LogP2.37
Rot. Bonds2

About [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone

[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone (PubChem CID 155981275) has the molecular formula C17H17N5O and a molecular weight of 307.36 g/mol. Its IUPAC name is [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone.

Molecular Properties

Compound Name[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
PubChem CID155981275
Molecular FormulaC17H17N5O
Molecular Weight307.36 g/mol
Exact Mass307.14
IUPAC Name[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
SMILESO=C(c1ccn[nH]1)N1CCC(c2ccc3cccnc3n2)CC1
InChIInChI=1S/C17H17N5O/c23-17(15-5-9-19-21-15)22-10-6-12(7-11-22)14-4-3-13-2-1-8-18-16(13)20-14/h1-5,8-9,12H,6-7,10-11H2,(H,19,21)
InChIKeyXGCNRFPRKWSCJA-UHFFFAOYSA-N
XLogP2.37
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

cyclopentyl-[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155941699
[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-[2-(trifluoromethyl)-3-pyridinyl]methanone
CID 155942020
(4-methyl-1,3-thiazol-5-yl)-[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155980501
(5-cyclopropyl-1,2-oxazol-3-yl)-[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 155799037
[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone
CID 155942225
[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1,2,3,4-tetrahydroisoquinolin-5-yl)methanone
CID 167825296
[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(2-phenyltriazol-4-yl)methanone
CID 155799572
[(5R,7S)-5,7-dimethyl-1,4,5,7-tetrahydropyrano[4,3-d]pyrazol-3-yl]-[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 146111343
1H-pyrazol-5-yl-[4-(quinolin-8-ylmethyl)piperidin-1-yl]methanone
CID 110098814
[4-[6-[(3-fluorophenyl)methyl]-2-pyridinyl]piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 95810149
1-(1H-pyrazole-5-carbonyl)piperidine-4-carboxamide
CID 166600812
(1-methylpiperidin-3-yl)-[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]methanone
CID 163347903

Frequently Asked Questions

What is the IUPAC name of [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone?
The IUPAC name of [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone (CID 155981275) is [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone.
What is the SMILES notation for [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone?
The canonical SMILES for [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone is O=C(c1ccn[nH]1)N1CCC(c2ccc3cccnc3n2)CC1.
What is the InChIKey of [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone?
The InChIKey is XGCNRFPRKWSCJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O/c23-17(15-5-9-19-21-15)22-10-6-12(7-11-22)14-4-3-13-2-1-8-18-16(13)20-14/h1-5,8-9,12H,6-7,10-11H2,(H,19,21).
What are the key properties of [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone?
[4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone has a molecular weight of 307.36 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1,8-naphthyridin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone is sourced from PubChem (CID 155981275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).