1-(cyclobutylmethylamino)-2-methylpropan-2-ol

C9H19NO — CID 60883782

IUPAC1-(cyclobutylmethylamino)-2-methylpropan-2-ol
SMILESCC(C)(O)CNCC1CCC1
InChIInChI=1S/C9H19NO/c1-9(2,11)7-10-6-8-4-3-5-8/h8,10-11H,3-7H2,1-2H3
InChIKeyQVUYKGLKJCQDLK-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.15
Rot. Bonds4

About 1-(cyclobutylmethylamino)-2-methylpropan-2-ol

1-(cyclobutylmethylamino)-2-methylpropan-2-ol (PubChem CID 60883782) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-(cyclobutylmethylamino)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(cyclobutylmethylamino)-2-methylpropan-2-ol
PubChem CID60883782
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name1-(cyclobutylmethylamino)-2-methylpropan-2-ol
SMILESCC(C)(O)CNCC1CCC1
InChIInChI=1S/C9H19NO/c1-9(2,11)7-10-6-8-4-3-5-8/h8,10-11H,3-7H2,1-2H3
InChIKeyQVUYKGLKJCQDLK-UHFFFAOYSA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethylamino)-2-methylpropan-2-ol?
The IUPAC name of 1-(cyclobutylmethylamino)-2-methylpropan-2-ol (CID 60883782) is 1-(cyclobutylmethylamino)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(cyclobutylmethylamino)-2-methylpropan-2-ol?
The canonical SMILES for 1-(cyclobutylmethylamino)-2-methylpropan-2-ol is CC(C)(O)CNCC1CCC1.
What is the InChIKey of 1-(cyclobutylmethylamino)-2-methylpropan-2-ol?
The InChIKey is QVUYKGLKJCQDLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-9(2,11)7-10-6-8-4-3-5-8/h8,10-11H,3-7H2,1-2H3.
What are the key properties of 1-(cyclobutylmethylamino)-2-methylpropan-2-ol?
1-(cyclobutylmethylamino)-2-methylpropan-2-ol has a molecular weight of 157.26 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethylamino)-2-methylpropan-2-ol is sourced from PubChem (CID 60883782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).