(5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone

C19H19N3OS — CID 92602431

IUPAC(5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone
SMILESCc1cc(C(=O)N2CCC[C@@H](c3cc4ncccc4cn3)C2)cs1
InChIInChI=1S/C19H19N3OS/c1-13-8-16(12-24-13)19(23)22-7-3-5-15(11-22)18-9-17-14(10-21-18)4-2-6-20-17/h2,4,6,8-10,12,15H,3,5,7,11H2,1H3/t15-/m1/s1
InChIKeyVLQFHRQAMHAZIB-OAHLLOKOSA-N
MW337.45 g/mol
LogP4.02
Rot. Bonds2

About (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone

(5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone (PubChem CID 92602431) has the molecular formula C19H19N3OS and a molecular weight of 337.45 g/mol. Its IUPAC name is (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone
PubChem CID92602431
Molecular FormulaC19H19N3OS
Molecular Weight337.45 g/mol
Exact Mass337.12
IUPAC Name(5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone
SMILESCc1cc(C(=O)N2CCC[C@@H](c3cc4ncccc4cn3)C2)cs1
InChIInChI=1S/C19H19N3OS/c1-13-8-16(12-24-13)19(23)22-7-3-5-15(11-22)18-9-17-14(10-21-18)4-2-6-20-17/h2,4,6,8-10,12,15H,3,5,7,11H2,1H3/t15-/m1/s1
InChIKeyVLQFHRQAMHAZIB-OAHLLOKOSA-N
XLogP4.02
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone with MolForge

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Related Compounds

(3-isoquinolin-3-ylpiperidin-1-yl)-(3-methylthiophen-2-yl)methanone
CID 110242641
[(3S)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-6-ylmethanone
CID 124986274
(3-chloropiperidin-1-yl)-(5-methylthiophen-3-yl)methanone
CID 130877497
2-(dimethylamino)-1-[4-(1,6-naphthyridin-7-yl)piperidin-1-yl]ethanone
CID 92606069
(4-methylphenyl)-(3-pyridin-2-ylpiperidin-1-yl)methanone
CID 121451790
[(3S)-3-isoquinolin-3-ylpiperidin-1-yl]-(5-methoxythiophen-2-yl)methanone
CID 92598369
[3-[2-methyl-6-(5-methyl-1H-imidazol-2-yl)pyrimidin-4-yl]piperidin-1-yl]-quinolin-3-ylmethanone
CID 110110902
[(3R)-3-(2-methylpyrimidin-4-yl)piperidin-1-yl]-pyridazin-4-ylmethanone
CID 124968705
[(3S)-3-hydroxypyrrolidin-1-yl]-(5-methylthiophen-3-yl)methanone
CID 130949994
2H-benzotriazol-5-yl-[3-(2-methylpyrimidin-4-yl)piperidin-1-yl]methanone
CID 110115037
[(3S)-3-[4-(4-methoxyphenyl)-6-methyl-2-pyridinyl]piperidin-1-yl]-quinolin-6-ylmethanone
CID 124968000
pyrimidin-5-yl-[3-(1H-pyrrolo[2,3-b]pyridin-2-yl)piperidin-1-yl]methanone
CID 110258753

Frequently Asked Questions

What is the IUPAC name of (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone?
The IUPAC name of (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone (CID 92602431) is (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone?
The canonical SMILES for (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone is Cc1cc(C(=O)N2CCC[C@@H](c3cc4ncccc4cn3)C2)cs1.
What is the InChIKey of (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone?
The InChIKey is VLQFHRQAMHAZIB-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H19N3OS/c1-13-8-16(12-24-13)19(23)22-7-3-5-15(11-22)18-9-17-14(10-21-18)4-2-6-20-17/h2,4,6,8-10,12,15H,3,5,7,11H2,1H3/t15-/m1/s1.
What are the key properties of (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone?
(5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone has a molecular weight of 337.45 g/mol, XLogP of 4.02, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylthiophen-3-yl)-[(3R)-3-(1,6-naphthyridin-7-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 92602431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).