(2-butan-2-yloxolan-2-yl)methanamine

C9H19NO — CID 126987670

IUPAC(2-butan-2-yloxolan-2-yl)methanamine
SMILESCCC(C)C1(CN)CCCO1
InChIInChI=1S/C9H19NO/c1-3-8(2)9(7-10)5-4-6-11-9/h8H,3-7,10H2,1-2H3
InChIKeyUSISXGLLFWDXKC-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.54
Rot. Bonds3

About (2-butan-2-yloxolan-2-yl)methanamine

(2-butan-2-yloxolan-2-yl)methanamine (PubChem CID 126987670) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is (2-butan-2-yloxolan-2-yl)methanamine.

Molecular Properties

Compound Name(2-butan-2-yloxolan-2-yl)methanamine
PubChem CID126987670
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name(2-butan-2-yloxolan-2-yl)methanamine
SMILESCCC(C)C1(CN)CCCO1
InChIInChI=1S/C9H19NO/c1-3-8(2)9(7-10)5-4-6-11-9/h8H,3-7,10H2,1-2H3
InChIKeyUSISXGLLFWDXKC-UHFFFAOYSA-N
XLogP1.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(bromomethyl)-2-butan-2-yloxolane
CID 130692054
2-butan-2-yl-2-(chloromethyl)oxolane
CID 126987650
ethane;2-ethyl-2-propan-2-yloxolane
CID 156888373
(2-propan-2-yloxolan-2-yl)methanol
CID 130663266
1,1-di(butan-2-yl)cycloheptane
CID 91149690
(3-butan-2-yloxetan-3-yl)methanamine
CID 139418018
4-butan-2-yloxan-4-amine
CID 79445166
N-methyl-1-(2-propan-2-yloxan-2-yl)methanamine
CID 130624449
1-butan-2-ylcyclohexane-1-thiol
CID 19850363
(2R)-2-methyl-2-propan-2-yloxolane
CID 59911363
(1-butan-2-yloxycycloheptyl)methanamine
CID 62108575
(1-butan-2-yloxycyclohexyl)methanamine
CID 62108209

Frequently Asked Questions

What is the IUPAC name of (2-butan-2-yloxolan-2-yl)methanamine?
The IUPAC name of (2-butan-2-yloxolan-2-yl)methanamine (CID 126987670) is (2-butan-2-yloxolan-2-yl)methanamine.
What is the SMILES notation for (2-butan-2-yloxolan-2-yl)methanamine?
The canonical SMILES for (2-butan-2-yloxolan-2-yl)methanamine is CCC(C)C1(CN)CCCO1.
What is the InChIKey of (2-butan-2-yloxolan-2-yl)methanamine?
The InChIKey is USISXGLLFWDXKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-8(2)9(7-10)5-4-6-11-9/h8H,3-7,10H2,1-2H3.
What are the key properties of (2-butan-2-yloxolan-2-yl)methanamine?
(2-butan-2-yloxolan-2-yl)methanamine has a molecular weight of 157.26 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-butan-2-yloxolan-2-yl)methanamine is sourced from PubChem (CID 126987670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).