5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine

C16H31N3 — CID 134321534

IUPAC5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine
SMILESCC1(C)CCCN1C1C(N)CNCC1C1CCCC1
InChIInChI=1S/C16H31N3/c1-16(2)8-5-9-19(16)15-13(10-18-11-14(15)17)12-6-3-4-7-12/h12-15,18H,3-11,17H2,1-2H3
InChIKeyIQYSZVKATKKKQO-UHFFFAOYSA-N
MW265.44 g/mol
LogP1.97
Rot. Bonds2

About 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine

5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine (PubChem CID 134321534) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine.

Molecular Properties

Compound Name5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine
PubChem CID134321534
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC Name5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine
SMILESCC1(C)CCCN1C1C(N)CNCC1C1CCCC1
InChIInChI=1S/C16H31N3/c1-16(2)8-5-9-19(16)15-13(10-18-11-14(15)17)12-6-3-4-7-12/h12-15,18H,3-11,17H2,1-2H3
InChIKeyIQYSZVKATKKKQO-UHFFFAOYSA-N
XLogP1.97
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine?
The IUPAC name of 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine (CID 134321534) is 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine.
What is the SMILES notation for 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine?
The canonical SMILES for 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine is CC1(C)CCCN1C1C(N)CNCC1C1CCCC1.
What is the InChIKey of 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine?
The InChIKey is IQYSZVKATKKKQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-16(2)8-5-9-19(16)15-13(10-18-11-14(15)17)12-6-3-4-7-12/h12-15,18H,3-11,17H2,1-2H3.
What are the key properties of 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine?
5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine has a molecular weight of 265.44 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-4-(2,2-dimethylpyrrolidin-1-yl)piperidin-3-amine is sourced from PubChem (CID 134321534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).