[3-(methylaminomethyl)pyrrolidin-3-yl]methanol

C7H16N2O — CID 22903653

IUPAC[3-(methylaminomethyl)pyrrolidin-3-yl]methanol
SMILESCNCC1(CO)CCNC1
InChIInChI=1S/C7H16N2O/c1-8-4-7(6-10)2-3-9-5-7/h8-10H,2-6H2,1H3
InChIKeyIIUJZRREJXOPQZ-UHFFFAOYSA-N
MW144.22 g/mol
LogP-0.82
Rot. Bonds3

About [3-(methylaminomethyl)pyrrolidin-3-yl]methanol

[3-(methylaminomethyl)pyrrolidin-3-yl]methanol (PubChem CID 22903653) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is [3-(methylaminomethyl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[3-(methylaminomethyl)pyrrolidin-3-yl]methanol
PubChem CID22903653
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name[3-(methylaminomethyl)pyrrolidin-3-yl]methanol
SMILESCNCC1(CO)CCNC1
InChIInChI=1S/C7H16N2O/c1-8-4-7(6-10)2-3-9-5-7/h8-10H,2-6H2,1H3
InChIKeyIIUJZRREJXOPQZ-UHFFFAOYSA-N
XLogP-0.82
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(methylaminomethyl)pyrrolidin-3-yl]methanol?
The IUPAC name of [3-(methylaminomethyl)pyrrolidin-3-yl]methanol (CID 22903653) is [3-(methylaminomethyl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [3-(methylaminomethyl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [3-(methylaminomethyl)pyrrolidin-3-yl]methanol is CNCC1(CO)CCNC1.
What is the InChIKey of [3-(methylaminomethyl)pyrrolidin-3-yl]methanol?
The InChIKey is IIUJZRREJXOPQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-8-4-7(6-10)2-3-9-5-7/h8-10H,2-6H2,1H3.
What are the key properties of [3-(methylaminomethyl)pyrrolidin-3-yl]methanol?
[3-(methylaminomethyl)pyrrolidin-3-yl]methanol has a molecular weight of 144.22 g/mol, XLogP of -0.82, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methylaminomethyl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 22903653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).