N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide

C14H27N3O — CID 113402351

IUPACN-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(CCCC2CCCN2)CC1
InChIInChI=1S/C14H27N3O/c1-12(18)16-14-6-10-17(11-7-14)9-3-5-13-4-2-8-15-13/h13-15H,2-11H2,1H3,(H,16,18)
InChIKeyZRNVPSLNCZWZEQ-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.12
Rot. Bonds5

About N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide

N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide (PubChem CID 113402351) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide
PubChem CID113402351
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(CCCC2CCCN2)CC1
InChIInChI=1S/C14H27N3O/c1-12(18)16-14-6-10-17(11-7-14)9-3-5-13-4-2-8-15-13/h13-15H,2-11H2,1H3,(H,16,18)
InChIKeyZRNVPSLNCZWZEQ-UHFFFAOYSA-N
XLogP1.12
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-butylpiperidin-4-yl)acetamide
CID 21136025
1-(3-pyrrolidin-2-ylpropyl)piperazine
CID 62480123
bis[1-(2-pyrrolidin-2-ylethyl)piperidin-4-yl]methanone
CID 174669277
N-[1-(2-iodoethyl)piperidin-4-yl]acetamide
CID 126991191
1-butyl-N-(pyrrolidin-2-ylmethyl)piperidin-4-amine
CID 106637748
4,4-dimethyl-1-(3-pyrrolidin-2-ylpropyl)azepane
CID 65281341
4-ethyl-1-(3-piperidin-2-ylpropyl)piperidine
CID 62212363
N-[1-(6-amino-5,5-dimethylhexyl)piperidin-4-yl]acetamide
CID 106708228
N-[1-[2-(3-methylpiperidin-2-yl)acetyl]piperidin-4-yl]acetamide
CID 107148029
1-(4-piperidin-2-ylbutyl)piperidine
CID 15057319
methyl 3-(4-acetamidopiperidin-1-yl)propanoate
CID 49438939
N-(1-butylpiperidin-4-yl)azepane-2-carboxamide
CID 64561841

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide?
The IUPAC name of N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide (CID 113402351) is N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide?
The canonical SMILES for N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide is CC(=O)NC1CCN(CCCC2CCCN2)CC1.
What is the InChIKey of N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide?
The InChIKey is ZRNVPSLNCZWZEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-12(18)16-14-6-10-17(11-7-14)9-3-5-13-4-2-8-15-13/h13-15H,2-11H2,1H3,(H,16,18).
What are the key properties of N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide?
N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide has a molecular weight of 253.39 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-pyrrolidin-2-ylpropyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 113402351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).