1-naphthalen-1-yl-4-pentylpiperazine

C19H26N2 — CID 20649330

IUPAC1-naphthalen-1-yl-4-pentylpiperazine
SMILESCCCCCN1CCN(c2cccc3ccccc23)CC1
InChIInChI=1S/C19H26N2/c1-2-3-6-12-20-13-15-21(16-14-20)19-11-7-9-17-8-4-5-10-18(17)19/h4-5,7-11H,2-3,6,12-16H2,1H3
InChIKeyRNUWQZBAHWFNJP-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.15
Rot. Bonds5

About 1-naphthalen-1-yl-4-pentylpiperazine

1-naphthalen-1-yl-4-pentylpiperazine (PubChem CID 20649330) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 1-naphthalen-1-yl-4-pentylpiperazine.

Molecular Properties

Compound Name1-naphthalen-1-yl-4-pentylpiperazine
PubChem CID20649330
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name1-naphthalen-1-yl-4-pentylpiperazine
SMILESCCCCCN1CCN(c2cccc3ccccc23)CC1
InChIInChI=1S/C19H26N2/c1-2-3-6-12-20-13-15-21(16-14-20)19-11-7-9-17-8-4-5-10-18(17)19/h4-5,7-11H,2-3,6,12-16H2,1H3
InChIKeyRNUWQZBAHWFNJP-UHFFFAOYSA-N
XLogP4.15
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

8-(4-pentylpiperazin-1-yl)quinoline
CID 20649338
1-(2,3-dichlorophenyl)-4-hexylpiperazine
CID 155107965
1-(3-chloro-2-methylphenyl)-4-pentylpiperazine
CID 20649335
1-butyl-4-(2,3-dichlorophenyl)piperazine
CID 58358826
N-[3-methyl-6-[4-(4-naphthalen-1-ylpiperazin-1-yl)butoxy]-2-pyridinyl]butanamide
CID 143300656
2-methyl-3-[3-(4-naphthalen-1-ylpiperazin-1-yl)propylamino]naphthalene-1,4-dione
CID 130182218
3-[3-(4-naphthalen-1-ylpiperazin-1-yl)propyl]-1,2,3-benzotriazin-4-one
CID 24777372
1-[4-(4-naphthalen-1-ylpiperazin-1-yl)butyl]-6,7-dihydro-5H-indol-4-one
CID 11361631
1-pentyl-4-[2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine
CID 23142693
1-pentyl-4-(2-spiro[2.5]octan-6-ylphenyl)piperazine
CID 23142276
1-(2,4-dimethylphenyl)-3-(4-naphthalen-1-ylpiperazin-1-yl)propan-1-one
CID 10667020
1-[3-(4-hexylpiperazin-1-yl)-2-prop-1-en-2-ylphenyl]ethanone
CID 168902831

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-4-pentylpiperazine?
The IUPAC name of 1-naphthalen-1-yl-4-pentylpiperazine (CID 20649330) is 1-naphthalen-1-yl-4-pentylpiperazine.
What is the SMILES notation for 1-naphthalen-1-yl-4-pentylpiperazine?
The canonical SMILES for 1-naphthalen-1-yl-4-pentylpiperazine is CCCCCN1CCN(c2cccc3ccccc23)CC1.
What is the InChIKey of 1-naphthalen-1-yl-4-pentylpiperazine?
The InChIKey is RNUWQZBAHWFNJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-2-3-6-12-20-13-15-21(16-14-20)19-11-7-9-17-8-4-5-10-18(17)19/h4-5,7-11H,2-3,6,12-16H2,1H3.
What are the key properties of 1-naphthalen-1-yl-4-pentylpiperazine?
1-naphthalen-1-yl-4-pentylpiperazine has a molecular weight of 282.43 g/mol, XLogP of 4.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yl-4-pentylpiperazine is sourced from PubChem (CID 20649330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).