N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide

C10H22N2O3S — CID 79551761

IUPACN-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide
SMILESCCNC(=O)C(C)NCC(C)(C)S(C)(=O)=O
InChIInChI=1S/C10H22N2O3S/c1-6-11-9(13)8(2)12-7-10(3,4)16(5,14)15/h8,12H,6-7H2,1-5H3,(H,11,13)
InChIKeyRNZRPWIQEQFMQE-UHFFFAOYSA-N
MW250.36 g/mol
LogP-0.08
Rot. Bonds6

About N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide

N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide (PubChem CID 79551761) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide.

Molecular Properties

Compound NameN-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide
PubChem CID79551761
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC NameN-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide
SMILESCCNC(=O)C(C)NCC(C)(C)S(C)(=O)=O
InChIInChI=1S/C10H22N2O3S/c1-6-11-9(13)8(2)12-7-10(3,4)16(5,14)15/h8,12H,6-7H2,1-5H3,(H,11,13)
InChIKeyRNZRPWIQEQFMQE-UHFFFAOYSA-N
XLogP-0.08
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-ethoxy-2-methylpropyl)amino]-N-ethylpropanamide
CID 114942081
N-ethyl-2-[[2-(ethylamino)-2-oxoethyl]amino]propanamide
CID 43401396
1-ethyl-3-(2-methyl-2-methylsulfonylpropyl)thiourea
CID 115675097
3-methyl-N-(2-methyl-2-methylsulfonylpropyl)-2-sulfanylbutanamide
CID 107032215
(2S)-2-amino-3-methyl-N-(2-methyl-2-methylsulfonylpropyl)butanamide
CID 79551034
2-bromo-3-methyl-N-(2-methyl-2-methylsulfonylpropyl)butanamide
CID 79563378
(2R)-2-(tert-butylamino)-N-ethylpropanamide
CID 146263926
2-[(2-methyl-2-methylsulfonylpropyl)carbamoylamino]propanoic acid
CID 79555921
4-[(2-methyl-2-methylsulfonylpropyl)carbamoylamino]pentanoic acid
CID 79556227
4-methyl-N-(2-methyl-2-methylsulfonylpropyl)pentan-2-amine
CID 79551975
2-(2,3-dimethylbutylamino)-N-ethylpropanamide
CID 64571125
N-ethyl-2-(prop-2-ynylamino)propanamide
CID 43086396

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide?
The IUPAC name of N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide (CID 79551761) is N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide.
What is the SMILES notation for N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide?
The canonical SMILES for N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide is CCNC(=O)C(C)NCC(C)(C)S(C)(=O)=O.
What is the InChIKey of N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide?
The InChIKey is RNZRPWIQEQFMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-6-11-9(13)8(2)12-7-10(3,4)16(5,14)15/h8,12H,6-7H2,1-5H3,(H,11,13).
What are the key properties of N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide?
N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide has a molecular weight of 250.36 g/mol, XLogP of -0.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]propanamide is sourced from PubChem (CID 79551761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).