methanamine;2-pyrrolidin-1-ylethanol

C7H18N2O — CID 126573602

IUPACmethanamine;2-pyrrolidin-1-ylethanol
SMILESCN.OCCN1CCCC1
InChIInChI=1S/C6H13NO.CH5N/c8-6-5-7-3-1-2-4-7;1-2/h8H,1-6H2;2H2,1H3
InChIKeyKYWUBEIEZUCREY-UHFFFAOYSA-N
MW146.23 g/mol
LogP-0.35
Rot. Bonds2

About methanamine;2-pyrrolidin-1-ylethanol

methanamine;2-pyrrolidin-1-ylethanol (PubChem CID 126573602) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is methanamine;2-pyrrolidin-1-ylethanol.

Molecular Properties

Compound Namemethanamine;2-pyrrolidin-1-ylethanol
PubChem CID126573602
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC Namemethanamine;2-pyrrolidin-1-ylethanol
SMILESCN.OCCN1CCCC1
InChIInChI=1S/C6H13NO.CH5N/c8-6-5-7-3-1-2-4-7;1-2/h8H,1-6H2;2H2,1H3
InChIKeyKYWUBEIEZUCREY-UHFFFAOYSA-N
XLogP-0.35
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methanamine;2-pyrrolidin-1-ylethanol?
The IUPAC name of methanamine;2-pyrrolidin-1-ylethanol (CID 126573602) is methanamine;2-pyrrolidin-1-ylethanol.
What is the SMILES notation for methanamine;2-pyrrolidin-1-ylethanol?
The canonical SMILES for methanamine;2-pyrrolidin-1-ylethanol is CN.OCCN1CCCC1.
What is the InChIKey of methanamine;2-pyrrolidin-1-ylethanol?
The InChIKey is KYWUBEIEZUCREY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.CH5N/c8-6-5-7-3-1-2-4-7;1-2/h8H,1-6H2;2H2,1H3.
What are the key properties of methanamine;2-pyrrolidin-1-ylethanol?
methanamine;2-pyrrolidin-1-ylethanol has a molecular weight of 146.23 g/mol, XLogP of -0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;2-pyrrolidin-1-ylethanol is sourced from PubChem (CID 126573602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).