[1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine

C15H29N3 — CID 63168694

IUPAC[1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine
SMILESNCC1(CN2CCC(N3CCCC3)C2)CCCC1
InChIInChI=1S/C15H29N3/c16-12-15(6-1-2-7-15)13-17-10-5-14(11-17)18-8-3-4-9-18/h14H,1-13,16H2
InChIKeyWOYYXBJPVLIBAO-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.68
Rot. Bonds4

About [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine

[1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine (PubChem CID 63168694) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine
PubChem CID63168694
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name[1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine
SMILESNCC1(CN2CCC(N3CCCC3)C2)CCCC1
InChIInChI=1S/C15H29N3/c16-12-15(6-1-2-7-15)13-17-10-5-14(11-17)18-8-3-4-9-18/h14H,1-13,16H2
InChIKeyWOYYXBJPVLIBAO-UHFFFAOYSA-N
XLogP1.68
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine?
The IUPAC name of [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine (CID 63168694) is [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine.
What is the SMILES notation for [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine?
The canonical SMILES for [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine is NCC1(CN2CCC(N3CCCC3)C2)CCCC1.
What is the InChIKey of [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine?
The InChIKey is WOYYXBJPVLIBAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c16-12-15(6-1-2-7-15)13-17-10-5-14(11-17)18-8-3-4-9-18/h14H,1-13,16H2.
What are the key properties of [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine?
[1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine has a molecular weight of 251.42 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine is sourced from PubChem (CID 63168694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).