2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol

C12H24N2O2 — CID 64810845

IUPAC2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol
SMILESCOCC1CCN(CC(N)(CO)C2CC2)C1
InChIInChI=1S/C12H24N2O2/c1-16-7-10-4-5-14(6-10)8-12(13,9-15)11-2-3-11/h10-11,15H,2-9,13H2,1H3
InChIKeyCHVXZELJCXFYMU-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.05
Rot. Bonds6

About 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol

2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol (PubChem CID 64810845) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol
PubChem CID64810845
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol
SMILESCOCC1CCN(CC(N)(CO)C2CC2)C1
InChIInChI=1S/C12H24N2O2/c1-16-7-10-4-5-14(6-10)8-12(13,9-15)11-2-3-11/h10-11,15H,2-9,13H2,1H3
InChIKeyCHVXZELJCXFYMU-UHFFFAOYSA-N
XLogP0.05
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propanoate
CID 64583947
2-amino-2-cyclopropyl-3-(3,4-dimethoxypyrrolidin-1-yl)propan-1-ol
CID 103540837
2-amino-2-cyclopropyl-3-[3-(dimethylamino)pyrrolidin-1-yl]propan-1-ol
CID 64791303
2-amino-2-cyclopropyl-3-(3-ethoxypiperidin-1-yl)propan-1-ol
CID 64827605
2-amino-2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)propan-1-ol
CID 64827068
2-cyclopropyl-2-(cyclopropylamino)-3-[3-(methoxymethyl)pyrrolidin-1-yl]propanoic acid
CID 64583342
2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol
CID 64791296
2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol
CID 106589129
methyl 2-amino-3-[3-(methoxymethyl)piperidin-1-yl]-2-methylpropanoate
CID 106588642
2-amino-3-[3-(methoxymethyl)piperidin-1-yl]-2-methylpropanenitrile
CID 106588532
3-[3-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpropan-1-amine
CID 106587324
3-[3-(methoxymethyl)pyrrolidin-1-yl]propane-1,2-diol
CID 115773044

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol?
The IUPAC name of 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol (CID 64810845) is 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol?
The canonical SMILES for 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol is COCC1CCN(CC(N)(CO)C2CC2)C1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol?
The InChIKey is CHVXZELJCXFYMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-16-7-10-4-5-14(6-10)8-12(13,9-15)11-2-3-11/h10-11,15H,2-9,13H2,1H3.
What are the key properties of 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol?
2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol has a molecular weight of 228.34 g/mol, XLogP of 0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-ol is sourced from PubChem (CID 64810845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).