2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine

C12H26N2O — CID 64568943

IUPAC2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine
SMILESCC(C)C(C)CNCCN1CCOCC1
InChIInChI=1S/C12H26N2O/c1-11(2)12(3)10-13-4-5-14-6-8-15-9-7-14/h11-13H,4-10H2,1-3H3
InChIKeySONNKQBDGVVAGN-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.20
Rot. Bonds6

About 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine

2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine (PubChem CID 64568943) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine
PubChem CID64568943
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine
SMILESCC(C)C(C)CNCCN1CCOCC1
InChIInChI=1S/C12H26N2O/c1-11(2)12(3)10-13-4-5-14-6-8-15-9-7-14/h11-13H,4-10H2,1-3H3
InChIKeySONNKQBDGVVAGN-UHFFFAOYSA-N
XLogP1.20
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2-morpholin-4-ylethylamino)propan-2-ol
CID 43393555
2,3-dimethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]butan-1-amine
CID 82888946
2-methyl-3-methylsulfanyl-N-(2-morpholin-4-ylethyl)propan-1-amine
CID 63964280
4-methyl-N-(2-morpholin-4-ylethyl)pentan-1-amine
CID 61044634
(2R)-N-(2-morpholin-4-ylethyl)-2-phenylpropan-1-amine
CID 28617584
2-N-cyclopropyl-2-N-methyl-1-N-(2-morpholin-4-ylethyl)propane-1,2-diamine
CID 114133400
CID 59303713
CID 59303713
N-(3-methylbutan-2-yl)-2-(2-morpholin-4-ylethylamino)acetamide
CID 60687185
2-methyl-N'-(2-morpholin-4-ylethyl)butane-1,4-diamine
CID 114987350
4-chloro-N-(2-morpholin-4-ylethyl)pentan-1-amine
CID 106121816
2-(2-morpholin-4-ylethylamino)acetonitrile
CID 28583059
3-methyl-2-(2-morpholin-4-ylethylamino)butan-1-ol
CID 79250355

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine?
The IUPAC name of 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine (CID 64568943) is 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine is CC(C)C(C)CNCCN1CCOCC1.
What is the InChIKey of 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine?
The InChIKey is SONNKQBDGVVAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-11(2)12(3)10-13-4-5-14-6-8-15-9-7-14/h11-13H,4-10H2,1-3H3.
What are the key properties of 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine?
2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-(2-morpholin-4-ylethyl)butan-1-amine is sourced from PubChem (CID 64568943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).