azane;2-butan-2-yloxybutane

C8H21NO — CID 87187028

IUPACazane;2-butan-2-yloxybutane
SMILESCCC(C)OC(C)CC.N
InChIInChI=1S/C8H18O.H3N/c1-5-7(3)9-8(4)6-2;/h7-8H,5-6H2,1-4H3;1H3
InChIKeySIERMNXAGSKQAF-UHFFFAOYSA-N
MW147.26 g/mol
LogP2.76
Rot. Bonds4

About azane;2-butan-2-yloxybutane

azane;2-butan-2-yloxybutane (PubChem CID 87187028) has the molecular formula C8H21NO and a molecular weight of 147.26 g/mol. Its IUPAC name is azane;2-butan-2-yloxybutane.

Molecular Properties

Compound Nameazane;2-butan-2-yloxybutane
PubChem CID87187028
Molecular FormulaC8H21NO
Molecular Weight147.26 g/mol
Exact Mass147.16
IUPAC Nameazane;2-butan-2-yloxybutane
SMILESCCC(C)OC(C)CC.N
InChIInChI=1S/C8H18O.H3N/c1-5-7(3)9-8(4)6-2;/h7-8H,5-6H2,1-4H3;1H3
InChIKeySIERMNXAGSKQAF-UHFFFAOYSA-N
XLogP2.76
TPSA44.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.26
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butan-2-yloxybutane;ethanol
CID 88614162
2-butan-2-yloxypropan-1-ol;fluoromethane
CID 145107348
2-butan-2-yloxybutane;3-methylbutan-1-ol
CID 175296093
(1R)-1-[(2R)-butan-2-yl]oxypropan-1-ol
CID 88904720
N-(2-butan-2-yloxypropyl)-2-methylpropan-1-amine
CID 62453630
2-butan-2-yloxy-N-propylpropan-1-amine
CID 62453626
2,2-di(butan-2-yloxy)ethanamine;hydrobromide
CID 173067148
3-butan-2-yloxypent-1-yne
CID 89195467
2-butan-2-yloxypropyl methanesulfonate
CID 118371475
butan-2-yloxymercury
CID 144602861
2,3-di(butan-2-yloxy)butanedioic acid
CID 87883512
2-butan-2-yloxybutane;ethane-1,2-diol;bis(2-sulfanylacetic acid)
CID 174496086

Frequently Asked Questions

What is the IUPAC name of azane;2-butan-2-yloxybutane?
The IUPAC name of azane;2-butan-2-yloxybutane (CID 87187028) is azane;2-butan-2-yloxybutane.
What is the SMILES notation for azane;2-butan-2-yloxybutane?
The canonical SMILES for azane;2-butan-2-yloxybutane is CCC(C)OC(C)CC.N.
What is the InChIKey of azane;2-butan-2-yloxybutane?
The InChIKey is SIERMNXAGSKQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O.H3N/c1-5-7(3)9-8(4)6-2;/h7-8H,5-6H2,1-4H3;1H3.
What are the key properties of azane;2-butan-2-yloxybutane?
azane;2-butan-2-yloxybutane has a molecular weight of 147.26 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2-butan-2-yloxybutane is sourced from PubChem (CID 87187028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).