4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine

C20H42N4O3 — CID 57143760

IUPAC4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine
SMILESCN(C)CCC(COCC(CCN(C)C)N1CCOCC1)N1CCOCC1
InChIInChI=1S/C20H42N4O3/c1-21(2)7-5-19(23-9-13-25-14-10-23)17-27-18-20(6-8-22(3)4)24-11-15-26-16-12-24/h19-20H,5-18H2,1-4H3
InChIKeyRTGYDDGPCRZLQS-UHFFFAOYSA-N
MW386.58 g/mol
LogP0.31
Rot. Bonds12

About 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine

4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine (PubChem CID 57143760) has the molecular formula C20H42N4O3 and a molecular weight of 386.58 g/mol. Its IUPAC name is 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine.

Molecular Properties

Compound Name4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine
PubChem CID57143760
Molecular FormulaC20H42N4O3
Molecular Weight386.58 g/mol
Exact Mass386.33
IUPAC Name4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine
SMILESCN(C)CCC(COCC(CCN(C)C)N1CCOCC1)N1CCOCC1
InChIInChI=1S/C20H42N4O3/c1-21(2)7-5-19(23-9-13-25-14-10-23)17-27-18-20(6-8-22(3)4)24-11-15-26-16-12-24/h19-20H,5-18H2,1-4H3
InChIKeyRTGYDDGPCRZLQS-UHFFFAOYSA-N
XLogP0.31
TPSA40.65 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds12
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.58
LogP ≤ 50.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine?
The IUPAC name of 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine (CID 57143760) is 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine.
What is the SMILES notation for 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine?
The canonical SMILES for 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine is CN(C)CCC(COCC(CCN(C)C)N1CCOCC1)N1CCOCC1.
What is the InChIKey of 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine?
The InChIKey is RTGYDDGPCRZLQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42N4O3/c1-21(2)7-5-19(23-9-13-25-14-10-23)17-27-18-20(6-8-22(3)4)24-11-15-26-16-12-24/h19-20H,5-18H2,1-4H3.
What are the key properties of 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine?
4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine has a molecular weight of 386.58 g/mol, XLogP of 0.31, 12 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(dimethylamino)-2-morpholin-4-ylbutoxy]-N,N-dimethyl-3-morpholin-4-ylbutan-1-amine is sourced from PubChem (CID 57143760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).