N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide

C11H24N2O3S — CID 47134700

IUPACN-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide
SMILESCC(C)OCCN1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C11H24N2O3S/c1-10(2)16-9-8-13-6-4-11(5-7-13)12-17(3,14)15/h10-12H,4-9H2,1-3H3
InChIKeyNQBSJDBZDJSJOP-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.43
Rot. Bonds6

About N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide

N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide (PubChem CID 47134700) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide
PubChem CID47134700
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC NameN-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide
SMILESCC(C)OCCN1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C11H24N2O3S/c1-10(2)16-9-8-13-6-4-11(5-7-13)12-17(3,14)15/h10-12H,4-9H2,1-3H3
InChIKeyNQBSJDBZDJSJOP-UHFFFAOYSA-N
XLogP0.43
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride
CID 119923511
1-methylsulfonyl-4-(2-propan-2-yloxyethyl)piperazine
CID 59596479
4-bromo-1-(2-propan-2-yloxyethyl)piperidine
CID 80679344
3-amino-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propanamide
CID 119898215
2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide
CID 119898185
(2S)-N-cyclopropyl-2-hydroxy-2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide
CID 129490273
4-(bromomethyl)-1-(2-propan-2-yloxyethyl)piperidine
CID 80677013
[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanamine
CID 61485123
1-(2-propan-2-yloxyethyl)-N-propylpyrrolidin-3-amine
CID 104761908
N-[1-[(2S)-butan-2-yl]piperidin-4-yl]methanesulfonamide
CID 130440772
1-cyclopropyl-4-(2-propan-2-yloxyethyl)piperazine
CID 166028340
N-(1-ethylpyrrolidin-3-yl)methanesulfonamide
CID 131150504

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide?
The IUPAC name of N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide (CID 47134700) is N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide.
What is the SMILES notation for N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide?
The canonical SMILES for N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide is CC(C)OCCN1CCC(NS(C)(=O)=O)CC1.
What is the InChIKey of N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide?
The InChIKey is NQBSJDBZDJSJOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-10(2)16-9-8-13-6-4-11(5-7-13)12-17(3,14)15/h10-12H,4-9H2,1-3H3.
What are the key properties of N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide?
N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide is sourced from PubChem (CID 47134700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).