2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine

C10H22N2O3S — CID 115876287

IUPAC2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine
SMILESCC(C)CNCCS(=O)(=O)N1CCOCC1
InChIInChI=1S/C10H22N2O3S/c1-10(2)9-11-3-8-16(13,14)12-4-6-15-7-5-12/h10-11H,3-9H2,1-2H3
InChIKeySWZBQAPGJXWSDN-UHFFFAOYSA-N
MW250.36 g/mol
LogP-0.11
Rot. Bonds6

About 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine

2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine (PubChem CID 115876287) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine
PubChem CID115876287
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine
SMILESCC(C)CNCCS(=O)(=O)N1CCOCC1
InChIInChI=1S/C10H22N2O3S/c1-10(2)9-11-3-8-16(13,14)12-4-6-15-7-5-12/h10-11H,3-9H2,1-2H3
InChIKeySWZBQAPGJXWSDN-UHFFFAOYSA-N
XLogP-0.11
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-2-morpholin-4-ylsulfonylethanamine
CID 59686763
4-(2-methylsulfonylethylsulfonyl)morpholine
CID 64591555
2-methyl-1-(3-methylbutyl)-3-(2-morpholin-4-ylsulfonylethyl)guanidine
CID 110978153
propan-2-yl 3-morpholin-4-ylsulfonylpropanoate
CID 112724899
(2S)-2-methyl-3-morpholin-4-ylsulfonylpropanoic acid
CID 42035723
N-(2-methylpropyl)-3-(1,4-oxazepan-4-yl)butan-1-amine
CID 62973036
2-methyl-1-(2-morpholin-4-ylsulfonylethyl)-3-(2-thiophen-3-ylpropyl)guanidine;hydroiodide
CID 111704506
4-propylsulfonyl-1,4-oxazepane
CID 62067172
N-(2-methylpropyl)-2-morpholin-4-ylpentan-1-amine
CID 83042710
4-(3-chloro-2-methylpropyl)sulfonylmorpholine
CID 79579785
1-tert-butyl-2-methyl-3-(2-morpholin-4-ylsulfonylethyl)guanidine
CID 110965766
N-[(2S)-butan-2-yl]morpholine-4-sulfonamide
CID 95135939

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine?
The IUPAC name of 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine (CID 115876287) is 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine.
What is the SMILES notation for 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine?
The canonical SMILES for 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine is CC(C)CNCCS(=O)(=O)N1CCOCC1.
What is the InChIKey of 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine?
The InChIKey is SWZBQAPGJXWSDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-10(2)9-11-3-8-16(13,14)12-4-6-15-7-5-12/h10-11H,3-9H2,1-2H3.
What are the key properties of 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine?
2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine has a molecular weight of 250.36 g/mol, XLogP of -0.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine is sourced from PubChem (CID 115876287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).