[1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine

C11H22N2 — CID 115311763

IUPAC[1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine
SMILESCCC(C1CC1)N1CCCC1CN
InChIInChI=1S/C11H22N2/c1-2-11(9-5-6-9)13-7-3-4-10(13)8-12/h9-11H,2-8,12H2,1H3
InChIKeyKCBJOXYMIIFSDY-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.60
Rot. Bonds4

About [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine

[1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine (PubChem CID 115311763) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine
PubChem CID115311763
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name[1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine
SMILESCCC(C1CC1)N1CCCC1CN
InChIInChI=1S/C11H22N2/c1-2-11(9-5-6-9)13-7-3-4-10(13)8-12/h9-11H,2-8,12H2,1H3
InChIKeyKCBJOXYMIIFSDY-UHFFFAOYSA-N
XLogP1.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine?
The IUPAC name of [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine (CID 115311763) is [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine?
The canonical SMILES for [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine is CCC(C1CC1)N1CCCC1CN.
What is the InChIKey of [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine?
The InChIKey is KCBJOXYMIIFSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-2-11(9-5-6-9)13-7-3-4-10(13)8-12/h9-11H,2-8,12H2,1H3.
What are the key properties of [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine?
[1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine has a molecular weight of 182.31 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-cyclopropylpropyl)pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 115311763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).