1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol

C12H24N2O — CID 106613911

IUPAC1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol
SMILESCN(CC1CCCN1)CC1(O)CCCC1
InChIInChI=1S/C12H24N2O/c1-14(9-11-5-4-8-13-11)10-12(15)6-2-3-7-12/h11,13,15H,2-10H2,1H3
InChIKeyCLAAOJCLTQOVNO-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.98
Rot. Bonds4

About 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol

1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol (PubChem CID 106613911) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol
PubChem CID106613911
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol
SMILESCN(CC1CCCN1)CC1(O)CCCC1
InChIInChI=1S/C12H24N2O/c1-14(9-11-5-4-8-13-11)10-12(15)6-2-3-7-12/h11,13,15H,2-10H2,1H3
InChIKeyCLAAOJCLTQOVNO-UHFFFAOYSA-N
XLogP0.98
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol (CID 106613911) is 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol is CN(CC1CCCN1)CC1(O)CCCC1.
What is the InChIKey of 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is CLAAOJCLTQOVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-14(9-11-5-4-8-13-11)10-12(15)6-2-3-7-12/h11,13,15H,2-10H2,1H3.
What are the key properties of 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 212.34 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 106613911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).