N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine

C12H26N2O — CID 62422885

IUPACN-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine
SMILESCCNCCCC(C)N1CCOCC1C
InChIInChI=1S/C12H26N2O/c1-4-13-7-5-6-11(2)14-8-9-15-10-12(14)3/h11-13H,4-10H2,1-3H3
InChIKeyIQIBYRZMWYYHRZ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.49
Rot. Bonds6

About N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine

N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine (PubChem CID 62422885) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine.

Molecular Properties

Compound NameN-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine
PubChem CID62422885
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine
SMILESCCNCCCC(C)N1CCOCC1C
InChIInChI=1S/C12H26N2O/c1-4-13-7-5-6-11(2)14-8-9-15-10-12(14)3/h11-13H,4-10H2,1-3H3
InChIKeyIQIBYRZMWYYHRZ-UHFFFAOYSA-N
XLogP1.49
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 ≤ 51.49
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-ethyl-4-(3-ethylmorpholin-4-yl)pentan-1-amine
CID 62432412
3-methyl-4-pentan-2-ylmorpholine
CID 130660502
N-ethyl-4-(3-methylmorpholin-4-yl)butan-1-amine
CID 62421385
(2R)-2-[(3R)-3-methylmorpholin-4-yl]propan-1-amine
CID 124710087
3-methyl-2-(3-methylmorpholin-4-yl)-N-propylbutan-1-amine
CID 62421381
N-[(4-pentan-2-ylmorpholin-3-yl)methyl]ethanamine
CID 107891811
(2S)-N-(dicyclopropylmethyl)-2-[(3R)-3-methylmorpholin-4-yl]propan-1-amine
CID 97322384
2-methyl-1-[2-(3-methylmorpholin-4-yl)propyl]-3-pentylguanidine;hydroiodide
CID 111834776
2-methyl-4-(3-methylmorpholin-4-yl)-2-(propylamino)pentanenitrile
CID 64727471
1-ethyl-2-[2-(3-methylmorpholin-4-yl)propyl]-3-[3-(2-methylpiperidin-1-yl)propyl]guanidine
CID 111839177
2-(3-methylmorpholin-4-yl)pentan-1-amine
CID 43541861
1-(3-ethoxypropyl)-2-methyl-3-[2-(3-methylmorpholin-4-yl)propyl]guanidine
CID 111836401

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine?
The IUPAC name of N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine (CID 62422885) is N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine.
What is the SMILES notation for N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine?
The canonical SMILES for N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine is CCNCCCC(C)N1CCOCC1C.
What is the InChIKey of N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine?
The InChIKey is IQIBYRZMWYYHRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-13-7-5-6-11(2)14-8-9-15-10-12(14)3/h11-13H,4-10H2,1-3H3.
What are the key properties of N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine?
N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(3-methylmorpholin-4-yl)pentan-1-amine is sourced from PubChem (CID 62422885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).