2-cyclopropyl-1-naphthalen-2-ylguanidine

C14H15N3 — CID 55068735

IUPAC2-cyclopropyl-1-naphthalen-2-ylguanidine
SMILESN/C(=N\C1CC1)Nc1ccc2ccccc2c1
InChIInChI=1S/C14H15N3/c15-14(16-12-7-8-12)17-13-6-5-10-3-1-2-4-11(10)9-13/h1-6,9,12H,7-8H2,(H3,15,16,17)
InChIKeyICFHOMSXVWFMNW-UHFFFAOYSA-N
MW225.30 g/mol
LogP2.73
Rot. Bonds2

About 2-cyclopropyl-1-naphthalen-2-ylguanidine

2-cyclopropyl-1-naphthalen-2-ylguanidine (PubChem CID 55068735) has the molecular formula C14H15N3 and a molecular weight of 225.30 g/mol. Its IUPAC name is 2-cyclopropyl-1-naphthalen-2-ylguanidine.

Molecular Properties

Compound Name2-cyclopropyl-1-naphthalen-2-ylguanidine
PubChem CID55068735
Molecular FormulaC14H15N3
Molecular Weight225.30 g/mol
Exact Mass225.13
IUPAC Name2-cyclopropyl-1-naphthalen-2-ylguanidine
SMILESN/C(=N\C1CC1)Nc1ccc2ccccc2c1
InChIInChI=1S/C14H15N3/c15-14(16-12-7-8-12)17-13-6-5-10-3-1-2-4-11(10)9-13/h1-6,9,12H,7-8H2,(H3,15,16,17)
InChIKeyICFHOMSXVWFMNW-UHFFFAOYSA-N
XLogP2.73
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-cyclopropyl-1-(4-phenylphenyl)guanidine
CID 62379811
2-cyclopropyl-1-(4-phenoxyphenyl)guanidine
CID 62380155
1-[3-(aminomethyl)phenyl]-2-cyclopropylguanidine
CID 18622151
2-cyclohexyl-1-phenylguanidine
CID 10900077
2-cyclopropyl-1-(3-methylsulfanylphenyl)guanidine
CID 62379412
2-cyclobutyl-1-(3-propan-2-ylphenyl)guanidine
CID 119146737
2-amino-N-naphthalen-2-ylcyclopropane-1-carboxamide
CID 55035485
2-cyclobutyl-1-(3,4-dimethoxyphenyl)guanidine
CID 119146747
1-(2-chlorophenyl)-2-cyclopropylguanidine
CID 62378718
2-cyclobutyl-1-(3,4-dimethoxyphenyl)guanidine;hydroiodide
CID 119146746
2-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide
CID 64823330
4-methyl-N-naphthalen-2-ylcyclohexane-1-carboxamide
CID 775974

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-naphthalen-2-ylguanidine?
The IUPAC name of 2-cyclopropyl-1-naphthalen-2-ylguanidine (CID 55068735) is 2-cyclopropyl-1-naphthalen-2-ylguanidine.
What is the SMILES notation for 2-cyclopropyl-1-naphthalen-2-ylguanidine?
The canonical SMILES for 2-cyclopropyl-1-naphthalen-2-ylguanidine is N/C(=N\C1CC1)Nc1ccc2ccccc2c1.
What is the InChIKey of 2-cyclopropyl-1-naphthalen-2-ylguanidine?
The InChIKey is ICFHOMSXVWFMNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3/c15-14(16-12-7-8-12)17-13-6-5-10-3-1-2-4-11(10)9-13/h1-6,9,12H,7-8H2,(H3,15,16,17).
What are the key properties of 2-cyclopropyl-1-naphthalen-2-ylguanidine?
2-cyclopropyl-1-naphthalen-2-ylguanidine has a molecular weight of 225.30 g/mol, XLogP of 2.73, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-naphthalen-2-ylguanidine is sourced from PubChem (CID 55068735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).