[1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol

C12H24N2O — CID 62975876

IUPAC[1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol
SMILESCC(C)CNC1(CO)CCN(C2CC2)C1
InChIInChI=1S/C12H24N2O/c1-10(2)7-13-12(9-15)5-6-14(8-12)11-3-4-11/h10-11,13,15H,3-9H2,1-2H3
InChIKeyWINOJBHOOYMBCD-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.83
Rot. Bonds5

About [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol

[1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol (PubChem CID 62975876) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol
PubChem CID62975876
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name[1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol
SMILESCC(C)CNC1(CO)CCN(C2CC2)C1
InChIInChI=1S/C12H24N2O/c1-10(2)7-13-12(9-15)5-6-14(8-12)11-3-4-11/h10-11,13,15H,3-9H2,1-2H3
InChIKeyWINOJBHOOYMBCD-UHFFFAOYSA-N
XLogP0.83
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol?
The IUPAC name of [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol (CID 62975876) is [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol is CC(C)CNC1(CO)CCN(C2CC2)C1.
What is the InChIKey of [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol?
The InChIKey is WINOJBHOOYMBCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10(2)7-13-12(9-15)5-6-14(8-12)11-3-4-11/h10-11,13,15H,3-9H2,1-2H3.
What are the key properties of [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol?
[1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol has a molecular weight of 212.34 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclopropyl-3-(2-methylpropylamino)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 62975876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).