N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine

C14H30N2O — CID 62561718

IUPACN-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine
SMILESCCC1CN(CCNCCC(C)(C)C)CCO1
InChIInChI=1S/C14H30N2O/c1-5-13-12-16(10-11-17-13)9-8-15-7-6-14(2,3)4/h13,15H,5-12H2,1-4H3
InChIKeySLQBQIBHPPNTHE-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.12
Rot. Bonds6

About N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine

N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine (PubChem CID 62561718) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine.

Molecular Properties

Compound NameN-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine
PubChem CID62561718
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine
SMILESCCC1CN(CCNCCC(C)(C)C)CCO1
InChIInChI=1S/C14H30N2O/c1-5-13-12-16(10-11-17-13)9-8-15-7-6-14(2,3)4/h13,15H,5-12H2,1-4H3
InChIKeySLQBQIBHPPNTHE-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.12
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

N-(2-ethoxyethyl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 62561352
N-(cyclopropylmethyl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 60866421
2-(2-ethylmorpholin-4-yl)-N-(2-methylsulfonylethyl)ethanamine
CID 62561719
N-[3-(2-ethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine
CID 60850473
N-[2-(2-ethylmorpholin-4-yl)ethyl]propan-2-amine
CID 60843262
N-[2-(2-ethylmorpholin-4-yl)ethyl]butan-2-amine
CID 60853221
4-(2-ethylmorpholin-4-yl)-2-methyl-2-(propylamino)butan-1-ol
CID 64795537
N-[2-(3-ethylpiperidin-1-yl)ethyl]-3,3-dimethylbutan-1-amine
CID 62561731
2,4-diethylmorpholine
CID 58988021
3-[(2,6-diethylmorpholin-4-yl)methyl]-1,5-bis(2-ethylmorpholin-4-yl)pentan-3-amine
CID 67928020
N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]propan-1-amine
CID 155707218
1-(2-ethylmorpholin-4-yl)-4,4-dimethylpentan-3-one
CID 62623866

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine?
The IUPAC name of N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine (CID 62561718) is N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine.
What is the SMILES notation for N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine?
The canonical SMILES for N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine is CCC1CN(CCNCCC(C)(C)C)CCO1.
What is the InChIKey of N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine?
The InChIKey is SLQBQIBHPPNTHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-13-12-16(10-11-17-13)9-8-15-7-6-14(2,3)4/h13,15H,5-12H2,1-4H3.
What are the key properties of N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine?
N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine is sourced from PubChem (CID 62561718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).