4-(2,2-dimethylmorpholin-4-yl)butan-1-amine

C10H22N2O — CID 43592480

IUPAC4-(2,2-dimethylmorpholin-4-yl)butan-1-amine
SMILESCC1(C)CN(CCCCN)CCO1
InChIInChI=1S/C10H22N2O/c1-10(2)9-12(7-8-13-10)6-4-3-5-11/h3-9,11H2,1-2H3
InChIKeyYDNIYAWZWKLYAH-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.84
Rot. Bonds4

About 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine

4-(2,2-dimethylmorpholin-4-yl)butan-1-amine (PubChem CID 43592480) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine.

Molecular Properties

Compound Name4-(2,2-dimethylmorpholin-4-yl)butan-1-amine
PubChem CID43592480
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name4-(2,2-dimethylmorpholin-4-yl)butan-1-amine
SMILESCC1(C)CN(CCCCN)CCO1
InChIInChI=1S/C10H22N2O/c1-10(2)9-12(7-8-13-10)6-4-3-5-11/h3-9,11H2,1-2H3
InChIKeyYDNIYAWZWKLYAH-UHFFFAOYSA-N
XLogP0.84
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.84
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

(4-(2-Methylpropyl)morpholin-2-yl)methanamine
CID 4962206
4-(Morpholin-4-yl)butan-1-amine
CID 233611
2,2-Dimethylmorpholine
CID 18959674
Dimethyl(2-(piperidin-4-yloxy)ethyl)amine
CID 43167826
Isobutyl-(3-morpholin-4-yl-propyl)-amine
CID 3151942
Butyl-(3-morpholin-4-yl-propyl)-amine
CID 3151943
Diethyl[2-(piperidin-4-yloxy)ethyl]amine
CID 43346288
2-(2,6-Dimethylmorpholin-4-yl)ethanamine
CID 2756423
(5-Morpholin-4-ylpentyl)amine
CID 7138467
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethan-1-amine
CID 7144968
3-(2,6-Dimethylmorpholin-4-yl)propan-1-amine
CID 10607302
4-(Morpholin-4-yl)butan-2-amine
CID 16767299

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine?
The IUPAC name of 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine (CID 43592480) is 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine.
What is the SMILES notation for 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine?
The canonical SMILES for 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine is CC1(C)CN(CCCCN)CCO1.
What is the InChIKey of 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine?
The InChIKey is YDNIYAWZWKLYAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-10(2)9-12(7-8-13-10)6-4-3-5-11/h3-9,11H2,1-2H3.
What are the key properties of 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine?
4-(2,2-dimethylmorpholin-4-yl)butan-1-amine has a molecular weight of 186.30 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethylmorpholin-4-yl)butan-1-amine is sourced from PubChem (CID 43592480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).