3-piperidin-1-ylpropan-1-amine

C8H18N2 — CID 19049

IUPAC3-piperidin-1-ylpropan-1-amine
SMILESNCCCN1CCCCC1
InChIInChI=1S/C8H18N2/c9-5-4-8-10-6-2-1-3-7-10/h1-9H2
InChIKeyJMUCXULQKPWSTJ-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.82
Rot. Bonds3

About 3-piperidin-1-ylpropan-1-amine

3-piperidin-1-ylpropan-1-amine (PubChem CID 19049) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 3-piperidin-1-ylpropan-1-amine.

Molecular Properties

Compound Name3-piperidin-1-ylpropan-1-amine
PubChem CID19049
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name3-piperidin-1-ylpropan-1-amine
SMILESNCCCN1CCCCC1
InChIInChI=1S/C8H18N2/c9-5-4-8-10-6-2-1-3-7-10/h1-9H2
InChIKeyJMUCXULQKPWSTJ-UHFFFAOYSA-N
XLogP0.82
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-Aminoethyl)piperidine
CID 33944
N,N-Dimethylpiperidin-4-amine
CID 417391
1-(2-Methylpropyl)piperidin-4-amine
CID 550780
1-Methyl-4-(methylamino)piperidine
CID 566323
1-Pentylpiperazine
CID 2737112
4-Amino-1-methylpiperidine
CID 2737531
3-(4-Methylpiperidin-1-yl)propan-1-amine
CID 3149264
1-(Propan-2-yl)piperidin-4-amine
CID 3163333
1-Ethylpiperidin-4-amine
CID 3734990
4-(Piperidin-1-yl)butan-1-amine
CID 6484144
3-(3,5-Dimethylpiperidin-1-yl)propan-1-amine
CID 6487611
N,N-diethylpiperidin-4-amine
CID 2758239

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-ylpropan-1-amine?
The IUPAC name of 3-piperidin-1-ylpropan-1-amine (CID 19049) is 3-piperidin-1-ylpropan-1-amine.
What is the SMILES notation for 3-piperidin-1-ylpropan-1-amine?
The canonical SMILES for 3-piperidin-1-ylpropan-1-amine is NCCCN1CCCCC1.
What is the InChIKey of 3-piperidin-1-ylpropan-1-amine?
The InChIKey is JMUCXULQKPWSTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c9-5-4-8-10-6-2-1-3-7-10/h1-9H2.
What are the key properties of 3-piperidin-1-ylpropan-1-amine?
3-piperidin-1-ylpropan-1-amine has a molecular weight of 142.25 g/mol, XLogP of 0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-ylpropan-1-amine is sourced from PubChem (CID 19049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).