4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine

C14H29N3 — CID 61215952

IUPAC4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine
SMILESCC(N)CCN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C14H29N3/c1-13(15)5-10-16-11-6-14(7-12-16)17-8-3-2-4-9-17/h13-14H,2-12,15H2,1H3
InChIKeyMMPZOQZCIJYGJF-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.67
Rot. Bonds4

About 4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine

4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine (PubChem CID 61215952) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine.

Molecular Properties

Compound Name4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine
PubChem CID61215952
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine
SMILESCC(N)CCN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C14H29N3/c1-13(15)5-10-16-11-6-14(7-12-16)17-8-3-2-4-9-17/h13-14H,2-12,15H2,1H3
InChIKeyMMPZOQZCIJYGJF-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

5-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 63169480
(2S)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-2-amine
CID 103934640
1-[1-(3-methylbutyl)pyrrolidin-3-yl]piperidine
CID 155151188
4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]butan-2-amine
CID 63009941
6-methyl-7-(3-piperidin-1-ylpyrrolidin-1-yl)heptan-2-amine
CID 65296095
4-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)butan-1-ol
CID 64826874
4-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)butanenitrile
CID 63027929
3-amino-4-(4-piperidin-1-ylpiperidin-1-yl)butan-1-ol
CID 64898995
2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butanamide
CID 63054591
2-(methylamino)-4-(4-piperidin-1-ylpiperidin-1-yl)butan-1-ol
CID 64826674
4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 64707229
2-methyl-4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine
CID 64679336

Frequently Asked Questions

What is the IUPAC name of 4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine?
The IUPAC name of 4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine (CID 61215952) is 4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine.
What is the SMILES notation for 4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine?
The canonical SMILES for 4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine is CC(N)CCN1CCC(N2CCCCC2)CC1.
What is the InChIKey of 4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine?
The InChIKey is MMPZOQZCIJYGJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-13(15)5-10-16-11-6-14(7-12-16)17-8-3-2-4-9-17/h13-14H,2-12,15H2,1H3.
What are the key properties of 4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine?
4-(4-piperidin-1-ylpiperidin-1-yl)butan-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-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine is sourced from PubChem (CID 61215952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).