N-(4-piperidin-1-ylbutyl)aniline

C15H24N2 — CID 67607520

IUPACN-(4-piperidin-1-ylbutyl)aniline
SMILESc1ccc(NCCCCN2CCCCC2)cc1
InChIInChI=1S/C15H24N2/c1-3-9-15(10-4-1)16-11-5-8-14-17-12-6-2-7-13-17/h1,3-4,9-10,16H,2,5-8,11-14H2
InChIKeyGERWUQSYCDVSSI-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.36
Rot. Bonds6

About N-(4-piperidin-1-ylbutyl)aniline

N-(4-piperidin-1-ylbutyl)aniline (PubChem CID 67607520) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-(4-piperidin-1-ylbutyl)aniline.

Molecular Properties

Compound NameN-(4-piperidin-1-ylbutyl)aniline
PubChem CID67607520
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-(4-piperidin-1-ylbutyl)aniline
SMILESc1ccc(NCCCCN2CCCCC2)cc1
InChIInChI=1S/C15H24N2/c1-3-9-15(10-4-1)16-11-5-8-14-17-12-6-2-7-13-17/h1,3-4,9-10,16H,2,5-8,11-14H2
InChIKeyGERWUQSYCDVSSI-UHFFFAOYSA-N
XLogP3.36
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(6-piperidin-1-ylhexyl)aniline
CID 70509590
N-[3-(4-chloropiperidin-1-yl)propyl]aniline
CID 70511270
N-(6-piperidin-1-ylhexyl)pyridin-4-amine;dihydrochloride
CID 11151770
2-anilino-N-[2-(azepan-1-yl)ethyl]acetamide
CID 61240014
4-chloro-N-(3-pyrrolidin-1-ylpropyl)aniline
CID 61494408
N-benzyl-6-piperidin-1-ylhexan-1-amine
CID 54404338
N-[4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)butyl]aniline;trihydrochloride
CID 22252291
N-[3-(1,3-dihydroisoindol-2-yl)propyl]aniline
CID 62570411
3-bromo-N-(3-pyrrolidin-1-ylpropyl)aniline
CID 59590019
N-[4-(3-pyrrolidin-1-ylpropylamino)phenyl]acetamide
CID 61494179
4-N,4-N-dimethyl-1-N-(3-pyrrolidin-1-ylpropyl)benzene-1,4-diamine
CID 54961012
N-[5-(azepan-1-yl)pentyl]benzenesulfonamide
CID 110444590

Frequently Asked Questions

What is the IUPAC name of N-(4-piperidin-1-ylbutyl)aniline?
The IUPAC name of N-(4-piperidin-1-ylbutyl)aniline (CID 67607520) is N-(4-piperidin-1-ylbutyl)aniline.
What is the SMILES notation for N-(4-piperidin-1-ylbutyl)aniline?
The canonical SMILES for N-(4-piperidin-1-ylbutyl)aniline is c1ccc(NCCCCN2CCCCC2)cc1.
What is the InChIKey of N-(4-piperidin-1-ylbutyl)aniline?
The InChIKey is GERWUQSYCDVSSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-9-15(10-4-1)16-11-5-8-14-17-12-6-2-7-13-17/h1,3-4,9-10,16H,2,5-8,11-14H2.
What are the key properties of N-(4-piperidin-1-ylbutyl)aniline?
N-(4-piperidin-1-ylbutyl)aniline has a molecular weight of 232.37 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-piperidin-1-ylbutyl)aniline is sourced from PubChem (CID 67607520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).