1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine

C9H18N2O — CID 103534745

IUPAC1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine
SMILESCOC1CCN(CC2(N)CC2)C1
InChIInChI=1S/C9H18N2O/c1-12-8-2-5-11(6-8)7-9(10)3-4-9/h8H,2-7,10H2,1H3
InChIKeyLURHWMPUNXZQMC-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.20
Rot. Bonds3

About 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine

1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine (PubChem CID 103534745) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine
PubChem CID103534745
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine
SMILESCOC1CCN(CC2(N)CC2)C1
InChIInChI=1S/C9H18N2O/c1-12-8-2-5-11(6-8)7-9(10)3-4-9/h8H,2-7,10H2,1H3
InChIKeyLURHWMPUNXZQMC-UHFFFAOYSA-N
XLogP0.20
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine?
The IUPAC name of 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine (CID 103534745) is 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine?
The canonical SMILES for 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine is COC1CCN(CC2(N)CC2)C1.
What is the InChIKey of 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine?
The InChIKey is LURHWMPUNXZQMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-12-8-2-5-11(6-8)7-9(10)3-4-9/h8H,2-7,10H2,1H3.
What are the key properties of 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine?
1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine has a molecular weight of 170.26 g/mol, XLogP of 0.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methoxypyrrolidin-1-yl)methyl]cyclopropan-1-amine is sourced from PubChem (CID 103534745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).