2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol

C17H26N2O2 — CID 115972171

IUPAC2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol
SMILESCC1(C)C(O)CC1Nc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C17H26N2O2/c1-17(2)15(11-16(17)20)18-14-5-3-13(4-6-14)12-19-7-9-21-10-8-19/h3-6,15-16,18,20H,7-12H2,1-2H3
InChIKeyUTDLTPJZNVUSBJ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.09
Rot. Bonds4

About 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol

2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol (PubChem CID 115972171) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol
PubChem CID115972171
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol
SMILESCC1(C)C(O)CC1Nc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C17H26N2O2/c1-17(2)15(11-16(17)20)18-14-5-3-13(4-6-14)12-19-7-9-21-10-8-19/h3-6,15-16,18,20H,7-12H2,1-2H3
InChIKeyUTDLTPJZNVUSBJ-UHFFFAOYSA-N
XLogP2.09
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-3-(4-propylanilino)cyclobutan-1-ol
CID 112633298
2-methyl-N-[4-(morpholin-4-ylmethyl)phenyl]oxolan-3-amine
CID 82726679
N-[4-(morpholin-4-ylmethyl)phenyl]thian-4-amine
CID 21192595
4-(morpholin-4-ylmethyl)-N-propan-2-ylaniline
CID 28716282
2,2-dimethyl-3-[4-(triazol-2-yl)anilino]cyclobutan-1-ol
CID 112633683
N-[1-(1-methylcyclopropyl)ethyl]-4-(morpholin-4-ylmethyl)aniline
CID 43363279
4-[[4-(2,2-dimethylpropyl)phenyl]methyl]morpholine
CID 59743834
N-[4-(morpholin-4-ylmethyl)phenyl]-1,1-dioxothian-4-amine
CID 21192616
3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol
CID 114629443
2-methyl-1-[4-(morpholin-4-ylmethyl)phenyl]guanidine
CID 89193384
N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine
CID 117318560
N-methoxy-1-[4-(morpholin-4-ylmethyl)phenyl]methanamine
CID 117345350

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol?
The IUPAC name of 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol (CID 115972171) is 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol is CC1(C)C(O)CC1Nc1ccc(CN2CCOCC2)cc1.
What is the InChIKey of 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol?
The InChIKey is UTDLTPJZNVUSBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-17(2)15(11-16(17)20)18-14-5-3-13(4-6-14)12-19-7-9-21-10-8-19/h3-6,15-16,18,20H,7-12H2,1-2H3.
What are the key properties of 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol?
2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol has a molecular weight of 290.41 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-[4-(morpholin-4-ylmethyl)anilino]cyclobutan-1-ol is sourced from PubChem (CID 115972171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).