(3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide

C17H23N5O2S — CID 97348278

IUPAC(3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide
SMILESO=S(=O)(NC1CCCC1)[C@H]1CCCN(c2ccc3nccnc3n2)C1
InChIInChI=1S/C17H23N5O2S/c23-25(24,21-13-4-1-2-5-13)14-6-3-11-22(12-14)16-8-7-15-17(20-16)19-10-9-18-15/h7-10,13-14,21H,1-6,11-12H2/t14-/m0/s1
InChIKeyVHUKVLAVSIDLNY-AWEZNQCLSA-N
MW361.47 g/mol
LogP1.86
Rot. Bonds4

About (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide

(3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide (PubChem CID 97348278) has the molecular formula C17H23N5O2S and a molecular weight of 361.47 g/mol. Its IUPAC name is (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide.

Molecular Properties

Compound Name(3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide
PubChem CID97348278
Molecular FormulaC17H23N5O2S
Molecular Weight361.47 g/mol
Exact Mass361.16
IUPAC Name(3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide
SMILESO=S(=O)(NC1CCCC1)[C@H]1CCCN(c2ccc3nccnc3n2)C1
InChIInChI=1S/C17H23N5O2S/c23-25(24,21-13-4-1-2-5-13)14-6-3-11-22(12-14)16-8-7-15-17(20-16)19-10-9-18-15/h7-10,13-14,21H,1-6,11-12H2/t14-/m0/s1
InChIKeyVHUKVLAVSIDLNY-AWEZNQCLSA-N
XLogP1.86
TPSA88.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclopentyl-1-(6,7-dichloroquinoxalin-2-yl)piperidine-3-sulfonamide
CID 133463706
(3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide
CID 124736119
N-[1-(6-chloroquinolin-2-yl)piperidin-3-yl]cyclopropanesulfonamide
CID 155942655
N-(1-pyrazin-2-ylpiperidin-3-yl)cyclopropanesulfonamide
CID 154829489
1-(6-cyano-3-pyridinyl)-N-cyclopentylpiperidine-3-sulfonamide
CID 86789283
(3R)-1-[(4-aminopyrimidin-2-yl)methyl]-N-cyclopentylpiperidine-3-sulfonamide
CID 124616923
6-[3-(phenoxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine
CID 133308222
4-methyl-2-(1-pyrido[2,3-b]pyrazin-6-ylpiperidin-3-yl)-1,3-thiazole
CID 133301256
6-(3-chloro-4-methylpiperidin-1-yl)pyrido[2,3-b]pyrazine
CID 102960882
N-(3-methyl-2-pyridinyl)-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-carboxamide
CID 51101967
N-(cyclopropylmethyl)-1-pyrido[2,3-b]pyrazin-6-ylpiperidin-4-amine
CID 115307509
5-(1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-3-yl)-1,2-dihydropyrazol-3-one
CID 154770924

Frequently Asked Questions

What is the IUPAC name of (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide?
The IUPAC name of (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide (CID 97348278) is (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide.
What is the SMILES notation for (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide?
The canonical SMILES for (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide is O=S(=O)(NC1CCCC1)[C@H]1CCCN(c2ccc3nccnc3n2)C1.
What is the InChIKey of (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide?
The InChIKey is VHUKVLAVSIDLNY-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H23N5O2S/c23-25(24,21-13-4-1-2-5-13)14-6-3-11-22(12-14)16-8-7-15-17(20-16)19-10-9-18-15/h7-10,13-14,21H,1-6,11-12H2/t14-/m0/s1.
What are the key properties of (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide?
(3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide has a molecular weight of 361.47 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide is sourced from PubChem (CID 97348278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).