N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide

C10H21NO2S — CID 63738151

IUPACN-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide
SMILESCC(C)N(CC1CC1)S(=O)(=O)C(C)C
InChIInChI=1S/C10H21NO2S/c1-8(2)11(7-10-5-6-10)14(12,13)9(3)4/h8-10H,5-7H2,1-4H3
InChIKeyVZXRKJLUCIIFSA-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.85
Rot. Bonds5

About N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide

N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide (PubChem CID 63738151) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide
PubChem CID63738151
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC NameN-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide
SMILESCC(C)N(CC1CC1)S(=O)(=O)C(C)C
InChIInChI=1S/C10H21NO2S/c1-8(2)11(7-10-5-6-10)14(12,13)9(3)4/h8-10H,5-7H2,1-4H3
InChIKeyVZXRKJLUCIIFSA-UHFFFAOYSA-N
XLogP1.85
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide (CID 63738151) is N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide is CC(C)N(CC1CC1)S(=O)(=O)C(C)C.
What is the InChIKey of N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide?
The InChIKey is VZXRKJLUCIIFSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-8(2)11(7-10-5-6-10)14(12,13)9(3)4/h8-10H,5-7H2,1-4H3.
What are the key properties of N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide?
N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide has a molecular weight of 219.35 g/mol, XLogP of 1.85, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-propan-2-ylpropane-2-sulfonamide is sourced from PubChem (CID 63738151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).