2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol

C13H26N2O2 — CID 64811260

IUPAC2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol
SMILESCOCC1CCN(CCC(CO)NC2CC2)C1
InChIInChI=1S/C13H26N2O2/c1-17-10-11-4-6-15(8-11)7-5-13(9-16)14-12-2-3-12/h11-14,16H,2-10H2,1H3
InChIKeyQLSDEEQSTOGBKV-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.46
Rot. Bonds8

About 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol

2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol (PubChem CID 64811260) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol
PubChem CID64811260
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol
SMILESCOCC1CCN(CCC(CO)NC2CC2)C1
InChIInChI=1S/C13H26N2O2/c1-17-10-11-4-6-15(8-11)7-5-13(9-16)14-12-2-3-12/h11-14,16H,2-10H2,1H3
InChIKeyQLSDEEQSTOGBKV-UHFFFAOYSA-N
XLogP0.46
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol
CID 103737990
methyl 2-(cyclopropylamino)-4-[4-(methoxymethyl)piperidin-1-yl]butanoate
CID 63971806
4-[3-(methoxymethyl)pyrrolidin-1-yl]-N-methylbutan-2-amine
CID 64568719
1-[3-(methoxymethyl)pyrrolidin-1-yl]-4,4-dimethylpentan-3-ol
CID 64581992
3-[4-(methoxymethyl)piperidin-1-yl]-2-(methylamino)propan-1-ol
CID 64790398
2-(cyclopropylamino)-4-(3-morpholin-4-ylpyrrolidin-1-yl)butan-1-ol
CID 64791909
3-[3-(methoxymethyl)pyrrolidin-1-yl]propane-1,2-diol
CID 115773044
2-(cyclopropylamino)-5-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylpentan-1-ol
CID 64809590
1-(2-iodoethyl)-3-(methoxymethyl)pyrrolidine
CID 131222845
1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine
CID 64583577
3-[4-(methoxymethyl)piperidin-1-yl]-2-(propan-2-ylamino)propan-1-ol
CID 64791193
2-amino-4-[3-(methoxymethyl)pyrrolidin-1-yl]butanamide
CID 64583951

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol (CID 64811260) is 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol is COCC1CCN(CCC(CO)NC2CC2)C1.
What is the InChIKey of 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol?
The InChIKey is QLSDEEQSTOGBKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-17-10-11-4-6-15(8-11)7-5-13(9-16)14-12-2-3-12/h11-14,16H,2-10H2,1H3.
What are the key properties of 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol?
2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol has a molecular weight of 242.36 g/mol, XLogP of 0.46, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-[3-(methoxymethyl)pyrrolidin-1-yl]butan-1-ol is sourced from PubChem (CID 64811260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).