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

C12H26N2O — CID 103462305

IUPAC2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine
SMILESCCC(C)(C)CNCCC1COCCN1
InChIInChI=1S/C12H26N2O/c1-4-12(2,3)10-13-6-5-11-9-15-8-7-14-11/h11,13-14H,4-10H2,1-3H3
InChIKeyFHZFNGCDEYGQHE-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.39
Rot. Bonds6

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

2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine (PubChem CID 103462305) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine
PubChem CID103462305
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine
SMILESCCC(C)(C)CNCCC1COCCN1
InChIInChI=1S/C12H26N2O/c1-4-12(2,3)10-13-6-5-11-9-15-8-7-14-11/h11,13-14H,4-10H2,1-3H3
InChIKeyFHZFNGCDEYGQHE-UHFFFAOYSA-N
XLogP1.39
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine
CID 115239068
2,2-dimethyl-N-(2-thiomorpholin-3-ylethyl)butan-1-amine
CID 103462147
2-(1-methylpiperidin-3-yl)-N-(2-morpholin-3-ylethyl)ethanamine
CID 115239031
ethane;2-methyl-N-(morpholin-3-ylmethyl)butan-2-amine
CID 142596245
3-(2-cyclopentylethyl)morpholine
CID 116928258
N-[(4-methoxyphenyl)methyl]-2-morpholin-3-ylethanamine
CID 115238941
N-[(3-methylphenyl)methyl]-2-morpholin-3-ylethanamine
CID 115238968
N-[(4-methylnaphthalen-1-yl)methyl]-2-morpholin-3-ylethanamine
CID 130392636
N-[(2-methoxyphenyl)methyl]-2-morpholin-3-ylethanamine
CID 115238972
3-[(2-methylpropan-2-yl)oxymethyl]morpholine
CID 58365003
N-[2-(4-bromothiophen-2-yl)ethyl]-2-morpholin-3-ylethanamine
CID 115239012
2,2,4-trimethyl-N-(2-pyrrolidin-2-ylethyl)pentan-1-amine
CID 115210501

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine?
The IUPAC name of 2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine (CID 103462305) is 2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine is CCC(C)(C)CNCCC1COCCN1.
What is the InChIKey of 2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine?
The InChIKey is FHZFNGCDEYGQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-12(2,3)10-13-6-5-11-9-15-8-7-14-11/h11,13-14H,4-10H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine?
2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-morpholin-3-ylethyl)butan-1-amine is sourced from PubChem (CID 103462305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).