N,N-dibutylaniline;4-phenylmorpholine

C24H36N2O — CID 159818534

IUPACN,N-dibutylaniline;4-phenylmorpholine
SMILESCCCCN(CCCC)c1ccccc1.c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C14H23N.C10H13NO/c1-3-5-12-15(13-6-4-2)14-10-8-7-9-11-14;1-2-4-10(5-3-1)11-6-8-12-9-7-11/h7-11H,3-6,12-13H2,1-2H3;1-5H,6-9H2
InChIKeyNLXXCZMXLOOGEE-UHFFFAOYSA-N
MW368.56 g/mol
LogP5.62
Rot. Bonds8

About N,N-dibutylaniline;4-phenylmorpholine

N,N-dibutylaniline;4-phenylmorpholine (PubChem CID 159818534) has the molecular formula C24H36N2O and a molecular weight of 368.56 g/mol. Its IUPAC name is N,N-dibutylaniline;4-phenylmorpholine.

Molecular Properties

Compound NameN,N-dibutylaniline;4-phenylmorpholine
PubChem CID159818534
Molecular FormulaC24H36N2O
Molecular Weight368.56 g/mol
Exact Mass368.28
IUPAC NameN,N-dibutylaniline;4-phenylmorpholine
SMILESCCCCN(CCCC)c1ccccc1.c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C14H23N.C10H13NO/c1-3-5-12-15(13-6-4-2)14-10-8-7-9-11-14;1-2-4-10(5-3-1)11-6-8-12-9-7-11/h7-11H,3-6,12-13H2,1-2H3;1-5H,6-9H2
InChIKeyNLXXCZMXLOOGEE-UHFFFAOYSA-N
XLogP5.62
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.56
LogP ≤ 55.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[4-[4-[(E)-2-[4-(dibutylamino)phenyl]ethenyl]phenyl]piperazin-1-yl]phenyl]-diphenylsulfanium
CID 59850647
N,N-di(nonyl)aniline
CID 22637953
N-heptyl-N-pentylaniline
CID 154378615
N,N-dibutyl-8-morpholin-4-yl-10H-phenothiazin-2-amine
CID 59442898
N,N-dibutyl-4-(4-ethylpiperidin-1-yl)aniline
CID 174155713
3-[N-(2-morpholin-4-ylethyl)anilino]propan-1-ol
CID 111543585
N,N-dibutylaniline;perchloric acid
CID 71443116
N,N-dibutylaniline;propane;prop-1-ene
CID 142114632
9-N,10-N-bis(4-morpholin-4-ylphenyl)-9-N,10-N-diphenylanthracene-9,10-diamine
CID 59133435
4-[N-(2-morpholin-4-ylethyl)anilino]butanoic acid
CID 60838256
3-phenyl-1,3-oxazolidine
CID 519787
N,N-dipropylaniline;ethane
CID 142135231

Frequently Asked Questions

What is the IUPAC name of N,N-dibutylaniline;4-phenylmorpholine?
The IUPAC name of N,N-dibutylaniline;4-phenylmorpholine (CID 159818534) is N,N-dibutylaniline;4-phenylmorpholine.
What is the SMILES notation for N,N-dibutylaniline;4-phenylmorpholine?
The canonical SMILES for N,N-dibutylaniline;4-phenylmorpholine is CCCCN(CCCC)c1ccccc1.c1ccc(N2CCOCC2)cc1.
What is the InChIKey of N,N-dibutylaniline;4-phenylmorpholine?
The InChIKey is NLXXCZMXLOOGEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N.C10H13NO/c1-3-5-12-15(13-6-4-2)14-10-8-7-9-11-14;1-2-4-10(5-3-1)11-6-8-12-9-7-11/h7-11H,3-6,12-13H2,1-2H3;1-5H,6-9H2.
What are the key properties of N,N-dibutylaniline;4-phenylmorpholine?
N,N-dibutylaniline;4-phenylmorpholine has a molecular weight of 368.56 g/mol, XLogP of 5.62, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutylaniline;4-phenylmorpholine is sourced from PubChem (CID 159818534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).