1-(pentyliminomethyl)naphthalen-2-ol

C16H19NO — CID 137231972

IUPAC1-(pentyliminomethyl)naphthalen-2-ol
SMILESCCCCC/N=C/c1c(O)ccc2ccccc12
InChIInChI=1S/C16H19NO/c1-2-3-6-11-17-12-15-14-8-5-4-7-13(14)9-10-16(15)18/h4-5,7-10,12,18H,2-3,6,11H2,1H3/b17-12+
InChIKeyFXMITICNTSPOPX-SFQUDFHCSA-N
MW241.33 g/mol
LogP4.15
Rot. Bonds5

About 1-(pentyliminomethyl)naphthalen-2-ol

1-(pentyliminomethyl)naphthalen-2-ol (PubChem CID 137231972) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-(pentyliminomethyl)naphthalen-2-ol.

Molecular Properties

Compound Name1-(pentyliminomethyl)naphthalen-2-ol
PubChem CID137231972
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name1-(pentyliminomethyl)naphthalen-2-ol
SMILESCCCCC/N=C/c1c(O)ccc2ccccc12
InChIInChI=1S/C16H19NO/c1-2-3-6-11-17-12-15-14-8-5-4-7-13(14)9-10-16(15)18/h4-5,7-10,12,18H,2-3,6,11H2,1H3/b17-12+
InChIKeyFXMITICNTSPOPX-SFQUDFHCSA-N
XLogP4.15
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-[2-(naphthalen-1-ylamino)ethyliminomethyl]naphthalen-2-ol
CID 137270230
1-[(E)-hydroxyiminomethyl]naphthalen-2-ol
CID 135400485
N-[(2-hydroxynaphthalen-1-yl)methylideneamino]dodecanamide
CID 5068789
1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol
CID 135596070
N-[(Z)-(2-hydroxynaphthalen-1-yl)methylideneamino]undecanamide
CID 135738478
1-(propan-2-yliminomethyl)naphthalen-2-ol
CID 4779256
1-[[3-[(2-hydroxynaphthalen-1-yl)methylideneamino]-2,3-dimethylbutan-2-yl]iminomethyl]naphthalen-2-ol
CID 136675821
1-[[2-[(2-hydroxynaphthalen-1-yl)methylideneamino]-1,2-diphenylethyl]iminomethyl]naphthalen-2-ol
CID 3576819
1-(benzhydryliminomethyl)naphthalen-2-ol
CID 135592591
N-hexyl-1-naphthalen-2-ylmethanimine
CID 10857572
1-butyl-3-[(2-hydroxynaphthalen-1-yl)methylideneamino]thiourea
CID 4537593
1-[(2-fluorophenyl)methyliminomethyl]naphthalen-2-ol
CID 135595992

Frequently Asked Questions

What is the IUPAC name of 1-(pentyliminomethyl)naphthalen-2-ol?
The IUPAC name of 1-(pentyliminomethyl)naphthalen-2-ol (CID 137231972) is 1-(pentyliminomethyl)naphthalen-2-ol.
What is the SMILES notation for 1-(pentyliminomethyl)naphthalen-2-ol?
The canonical SMILES for 1-(pentyliminomethyl)naphthalen-2-ol is CCCCC/N=C/c1c(O)ccc2ccccc12.
What is the InChIKey of 1-(pentyliminomethyl)naphthalen-2-ol?
The InChIKey is FXMITICNTSPOPX-SFQUDFHCSA-N. The full InChI is InChI=1S/C16H19NO/c1-2-3-6-11-17-12-15-14-8-5-4-7-13(14)9-10-16(15)18/h4-5,7-10,12,18H,2-3,6,11H2,1H3/b17-12+.
What are the key properties of 1-(pentyliminomethyl)naphthalen-2-ol?
1-(pentyliminomethyl)naphthalen-2-ol has a molecular weight of 241.33 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(pentyliminomethyl)naphthalen-2-ol is sourced from PubChem (CID 137231972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).