4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine

C14H29N3 — CID 64707229

IUPAC4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
SMILESCC(N)CC(C)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C14H29N3/c1-12(15)10-13(2)17-9-6-14(11-17)16-7-4-3-5-8-16/h12-14H,3-11,15H2,1-2H3
InChIKeyMBEDKZIAQWWUQV-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.67
Rot. Bonds4

About 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine

4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine (PubChem CID 64707229) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine.

Molecular Properties

Compound Name4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
PubChem CID64707229
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
SMILESCC(N)CC(C)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C14H29N3/c1-12(15)10-13(2)17-9-6-14(11-17)16-7-4-3-5-8-16/h12-14H,3-11,15H2,1-2H3
InChIKeyMBEDKZIAQWWUQV-UHFFFAOYSA-N
XLogP1.67
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-propan-2-ylpyrrolidin-3-yl)piperidine
CID 58850224
(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine
CID 130210207
4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide
CID 63584460
3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butanoic acid
CID 63170702
N-propyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 64706614
2-amino-2-methyl-4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanenitrile
CID 64725328
N-[2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propyl]cyclopentanamine
CID 63167834
1-[(1S)-1-iodoethyl]-3-pyrrolidin-1-ylpyrrolidine
CID 130220331
4-(4-cyclopropylpiperazin-1-yl)pentan-2-amine
CID 64706994
3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
CID 63171314
(2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine
CID 103934640
4,4-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 63171716

Frequently Asked Questions

What is the IUPAC name of 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine?
The IUPAC name of 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine (CID 64707229) is 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine.
What is the SMILES notation for 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine?
The canonical SMILES for 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine is CC(N)CC(C)N1CCC(N2CCCCC2)C1.
What is the InChIKey of 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine?
The InChIKey is MBEDKZIAQWWUQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-12(15)10-13(2)17-9-6-14(11-17)16-7-4-3-5-8-16/h12-14H,3-11,15H2,1-2H3.
What are the key properties of 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine?
4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine has a molecular weight of 239.41 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine is sourced from PubChem (CID 64707229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).