(3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide

C15H24N4O3S — CID 124736119

IUPAC(3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide
SMILESCOc1ccnc(N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)n1
InChIInChI=1S/C15H24N4O3S/c1-22-14-8-9-16-15(17-14)19-10-4-7-13(11-19)23(20,21)18-12-5-2-3-6-12/h8-9,12-13,18H,2-7,10-11H2,1H3/t13-/m0/s1
InChIKeyORYVASFBKYFJQA-ZDUSSCGKSA-N
MW340.45 g/mol
LogP1.32
Rot. Bonds5

About (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide

(3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide (PubChem CID 124736119) has the molecular formula C15H24N4O3S and a molecular weight of 340.45 g/mol. Its IUPAC name is (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name(3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide
PubChem CID124736119
Molecular FormulaC15H24N4O3S
Molecular Weight340.45 g/mol
Exact Mass340.16
IUPAC Name(3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide
SMILESCOc1ccnc(N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)n1
InChIInChI=1S/C15H24N4O3S/c1-22-14-8-9-16-15(17-14)19-10-4-7-13(11-19)23(20,21)18-12-5-2-3-6-12/h8-9,12-13,18H,2-7,10-11H2,1H3/t13-/m0/s1
InChIKeyORYVASFBKYFJQA-ZDUSSCGKSA-N
XLogP1.32
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-methoxy-2-[(3R)-3-pyrrolidin-1-ylsulfonylpyrrolidin-1-yl]pyrimidine
CID 124575255
2-(3-fluoropiperidin-1-yl)-4-methoxypyrimidine
CID 171701610
tert-butyl N-[(3R)-1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]carbamate
CID 97007663
4-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyrimidine
CID 126817206
2-[1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]acetic acid
CID 55104995
1-[(3R)-1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]pyrrolidin-2-one
CID 95557149
(3S)-N-cyclopentyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-3-sulfonamide
CID 97348278
N-tert-butyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-carboxamide
CID 166600760
2-[1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]ethanamine
CID 63761850
N-[4-cyclopropyl-1-(4-methoxypyrimidin-2-yl)pyrrolidin-3-yl]methanesulfonamide
CID 156603641
N-[1-(4,6-dimethoxypyrimidin-2-yl)piperidin-4-yl]cyclopropanesulfonamide
CID 146074487
N-[5-[(3R)-1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide
CID 97343986

Frequently Asked Questions

What is the IUPAC name of (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide?
The IUPAC name of (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide (CID 124736119) is (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide.
What is the SMILES notation for (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide?
The canonical SMILES for (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide is COc1ccnc(N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)n1.
What is the InChIKey of (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide?
The InChIKey is ORYVASFBKYFJQA-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H24N4O3S/c1-22-14-8-9-16-15(17-14)19-10-4-7-13(11-19)23(20,21)18-12-5-2-3-6-12/h8-9,12-13,18H,2-7,10-11H2,1H3/t13-/m0/s1.
What are the key properties of (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide?
(3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide has a molecular weight of 340.45 g/mol, XLogP of 1.32, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-cyclopentyl-1-(4-methoxypyrimidin-2-yl)piperidine-3-sulfonamide is sourced from PubChem (CID 124736119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).