4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine

C16H35N3O — CID 159962975

IUPAC4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine
SMILESCC(C)(C)N1CCC(N)C1.CC(C)(C)N1CCOCC1
InChIInChI=1S/C8H18N2.C8H17NO/c1-8(2,3)10-5-4-7(9)6-10;1-8(2,3)9-4-6-10-7-5-9/h7H,4-6,9H2,1-3H3;4-7H2,1-3H3
InChIKeyODOKIOYRCXSUSV-UHFFFAOYSA-N
MW285.48 g/mol
LogP1.93
Rot. Bonds

About 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine

4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine (PubChem CID 159962975) has the molecular formula C16H35N3O and a molecular weight of 285.48 g/mol. Its IUPAC name is 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine.

Molecular Properties

Compound Name4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine
PubChem CID159962975
Molecular FormulaC16H35N3O
Molecular Weight285.48 g/mol
Exact Mass285.28
IUPAC Name4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine
SMILESCC(C)(C)N1CCC(N)C1.CC(C)(C)N1CCOCC1
InChIInChI=1S/C8H18N2.C8H17NO/c1-8(2,3)10-5-4-7(9)6-10;1-8(2,3)9-4-6-10-7-5-9/h7H,4-6,9H2,1-3H3;4-7H2,1-3H3
InChIKeyODOKIOYRCXSUSV-UHFFFAOYSA-N
XLogP1.93
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.48
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-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

(3S)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butylpyrrolidin-3-amine
CID 159904713
4-(1-tert-butylpyrrolidin-3-yl)morpholine
CID 58364982
4-tert-butylmorpholine;2-methoxy-2-methylpropane
CID 159275308
1-(2-methylbutan-2-yl)pyrrolidin-3-amine
CID 43315387
1-tert-butyl-4-methylpiperidine;1-tert-butyl-3-methylpyrrolidine;4-tert-butylmorpholine;1-tert-butylpyrrolidine-3-carboxylic acid;methane
CID 159164271
1-tert-butyl-4-[(3R)-1-tert-butylpyrrolidin-3-yl]piperidine
CID 176629990
1-tert-butyl-4-[(3S)-1-tert-butylpyrrolidin-3-yl]piperidine
CID 176629837
(1-tert-butylpiperidin-4-yl)-morpholin-4-ylmethanone
CID 21061611
1-tert-butylazetidine;4-tert-butylmorpholine;1-tert-butylpiperidine;1-tert-butylpyrrolidine;ethane;methane
CID 157094866
4-tert-butyl-2-fluoromorpholine
CID 168840336
2-morpholin-4-ylpropane-2-thiol
CID 139318537
(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol
CID 90286839

Frequently Asked Questions

What is the IUPAC name of 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine?
The IUPAC name of 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine (CID 159962975) is 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine.
What is the SMILES notation for 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine?
The canonical SMILES for 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine is CC(C)(C)N1CCC(N)C1.CC(C)(C)N1CCOCC1.
What is the InChIKey of 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine?
The InChIKey is ODOKIOYRCXSUSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2.C8H17NO/c1-8(2,3)10-5-4-7(9)6-10;1-8(2,3)9-4-6-10-7-5-9/h7H,4-6,9H2,1-3H3;4-7H2,1-3H3.
What are the key properties of 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine?
4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine has a molecular weight of 285.48 g/mol, XLogP of 1.93, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butylmorpholine;1-tert-butylpyrrolidin-3-amine is sourced from PubChem (CID 159962975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).