1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine

C15H31N3 — CID 79549233

IUPAC1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine
SMILESCC(CC1CCCCN1)NCCCN1CCCC1
InChIInChI=1S/C15H31N3/c1-14(13-15-7-2-3-8-17-15)16-9-6-12-18-10-4-5-11-18/h14-17H,2-13H2,1H3
InChIKeyLACMUKZYWYSCRZ-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.98
Rot. Bonds7

About 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine

1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine (PubChem CID 79549233) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine.

Molecular Properties

Compound Name1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine
PubChem CID79549233
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine
SMILESCC(CC1CCCCN1)NCCCN1CCCC1
InChIInChI=1S/C15H31N3/c1-14(13-15-7-2-3-8-17-15)16-9-6-12-18-10-4-5-11-18/h14-17H,2-13H2,1H3
InChIKeyLACMUKZYWYSCRZ-UHFFFAOYSA-N
XLogP1.98
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(azepan-2-yl)-N-[2-(azepan-1-yl)ethyl]propan-2-amine
CID 79560062
N-[3-(4-methylpiperazin-1-yl)propyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79541234
1-(azepan-2-yl)-N-[3-(2-methylpiperidin-1-yl)propyl]propan-2-amine
CID 79541130
N-[2-(4-methylpiperazin-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79539939
4-(1-piperidin-2-ylpropan-2-ylamino)butan-1-ol
CID 106840824
5-(1-piperidin-2-ylpropan-2-ylamino)pentan-1-ol
CID 107316724
N-(2-morpholin-4-ylethyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79541011
4,4,4-trifluoro-N-(1-piperidin-2-ylpropan-2-yl)butan-1-amine
CID 115516388
N-[3-[1-(azepan-2-yl)propan-2-ylamino]propyl]methanesulfonamide
CID 106333370
N-(1-piperidin-2-ylpropan-2-yl)but-3-yn-1-amine
CID 79538896
N-[1-(azepan-2-yl)propan-2-yl]-4-methoxybutan-1-amine
CID 79560965
4-methyl-N-(1-pyrrolidin-2-ylpropan-2-yl)pentan-1-amine
CID 79540929

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine?
The IUPAC name of 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine (CID 79549233) is 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine.
What is the SMILES notation for 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine?
The canonical SMILES for 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine is CC(CC1CCCCN1)NCCCN1CCCC1.
What is the InChIKey of 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine?
The InChIKey is LACMUKZYWYSCRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-14(13-15-7-2-3-8-17-15)16-9-6-12-18-10-4-5-11-18/h14-17H,2-13H2,1H3.
What are the key properties of 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine?
1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine has a molecular weight of 253.43 g/mol, XLogP of 1.98, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine is sourced from PubChem (CID 79549233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).