butane;4-(2-methylpropyl)morpholine

C12H27NO — CID 155751822

IUPACbutane;4-(2-methylpropyl)morpholine
SMILESCC(C)CN1CCOCC1.CCCC
InChIInChI=1S/C8H17NO.C4H10/c1-8(2)7-9-3-5-10-6-4-9;1-3-4-2/h8H,3-7H2,1-2H3;3-4H2,1-2H3
InChIKeyFKZCHWBGCRPYET-UHFFFAOYSA-N
MW201.35 g/mol
LogP2.78
Rot. Bonds3

About butane;4-(2-methylpropyl)morpholine

butane;4-(2-methylpropyl)morpholine (PubChem CID 155751822) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is butane;4-(2-methylpropyl)morpholine.

Molecular Properties

Compound Namebutane;4-(2-methylpropyl)morpholine
PubChem CID155751822
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC Namebutane;4-(2-methylpropyl)morpholine
SMILESCC(C)CN1CCOCC1.CCCC
InChIInChI=1S/C8H17NO.C4H10/c1-8(2)7-9-3-5-10-6-4-9;1-3-4-2/h8H,3-7H2,1-2H3;3-4H2,1-2H3
InChIKeyFKZCHWBGCRPYET-UHFFFAOYSA-N
XLogP2.78
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]morpholine
CID 91228276
ethane;1-methoxybutane;4-(2-methylpropyl)morpholine
CID 163400303
ethane;4-(2-methylbutyl)morpholine
CID 142525427
4-(2-bromohexyl)morpholine
CID 19907055
4-[(2R)-1-morpholin-4-ylpropan-2-yl]morpholine
CID 28775628
1-[10-(2-hydroxypropyl)-7-propyl-1-oxa-4,7,10-triazacyclododec-4-yl]propan-2-ol
CID 142476457
(2S)-4-methyl-1-morpholin-4-ylpentan-2-amine
CID 18649577
1-(2-methoxyethyl)-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine
CID 161159887
N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675929
methane;1-(2-methoxyethyl)-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine
CID 158580646
4-tert-butylmorpholine;1-tert-butylpiperidine;1-tert-butylpyrrolidine;1-(2-methylpropyl)piperidine
CID 167566167
butane;4-butylmorpholine
CID 177152600

Frequently Asked Questions

What is the IUPAC name of butane;4-(2-methylpropyl)morpholine?
The IUPAC name of butane;4-(2-methylpropyl)morpholine (CID 155751822) is butane;4-(2-methylpropyl)morpholine.
What is the SMILES notation for butane;4-(2-methylpropyl)morpholine?
The canonical SMILES for butane;4-(2-methylpropyl)morpholine is CC(C)CN1CCOCC1.CCCC.
What is the InChIKey of butane;4-(2-methylpropyl)morpholine?
The InChIKey is FKZCHWBGCRPYET-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.C4H10/c1-8(2)7-9-3-5-10-6-4-9;1-3-4-2/h8H,3-7H2,1-2H3;3-4H2,1-2H3.
What are the key properties of butane;4-(2-methylpropyl)morpholine?
butane;4-(2-methylpropyl)morpholine has a molecular weight of 201.35 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butane;4-(2-methylpropyl)morpholine is sourced from PubChem (CID 155751822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).