2-(cyclobutylmethylamino)propan-1-ol

C8H17NO — CID 65460320

IUPAC2-(cyclobutylmethylamino)propan-1-ol
SMILESCC(CO)NCC1CCC1
InChIInChI=1S/C8H17NO/c1-7(6-10)9-5-8-3-2-4-8/h7-10H,2-6H2,1H3
InChIKeyJQWURHQWUTWQOF-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.76
Rot. Bonds4

About 2-(cyclobutylmethylamino)propan-1-ol

2-(cyclobutylmethylamino)propan-1-ol (PubChem CID 65460320) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 2-(cyclobutylmethylamino)propan-1-ol.

Molecular Properties

Compound Name2-(cyclobutylmethylamino)propan-1-ol
PubChem CID65460320
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name2-(cyclobutylmethylamino)propan-1-ol
SMILESCC(CO)NCC1CCC1
InChIInChI=1S/C8H17NO/c1-7(6-10)9-5-8-3-2-4-8/h7-10H,2-6H2,1H3
InChIKeyJQWURHQWUTWQOF-UHFFFAOYSA-N
XLogP0.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclobutylmethylamino)propan-1-ol?
The IUPAC name of 2-(cyclobutylmethylamino)propan-1-ol (CID 65460320) is 2-(cyclobutylmethylamino)propan-1-ol.
What is the SMILES notation for 2-(cyclobutylmethylamino)propan-1-ol?
The canonical SMILES for 2-(cyclobutylmethylamino)propan-1-ol is CC(CO)NCC1CCC1.
What is the InChIKey of 2-(cyclobutylmethylamino)propan-1-ol?
The InChIKey is JQWURHQWUTWQOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(6-10)9-5-8-3-2-4-8/h7-10H,2-6H2,1H3.
What are the key properties of 2-(cyclobutylmethylamino)propan-1-ol?
2-(cyclobutylmethylamino)propan-1-ol has a molecular weight of 143.23 g/mol, XLogP of 0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclobutylmethylamino)propan-1-ol is sourced from PubChem (CID 65460320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).