2-methoxynaphthalene-1-carboximidamide

C12H12N2O — CID 5018470

IUPAC2-methoxynaphthalene-1-carboximidamide
SMILES[H]/N=C(\N)c1c(OC)ccc2ccccc12
InChIInChI=1S/C12H12N2O/c1-15-10-7-6-8-4-2-3-5-9(8)11(10)12(13)14/h2-7H,1H3,(H3,13,14)
InChIKeyRCIGPOBMYPKFBY-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.13
Rot. Bonds2

About 2-methoxynaphthalene-1-carboximidamide

2-methoxynaphthalene-1-carboximidamide (PubChem CID 5018470) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 2-methoxynaphthalene-1-carboximidamide.

Molecular Properties

Compound Name2-methoxynaphthalene-1-carboximidamide
PubChem CID5018470
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name2-methoxynaphthalene-1-carboximidamide
SMILES[H]/N=C(\N)c1c(OC)ccc2ccccc12
InChIInChI=1S/C12H12N2O/c1-15-10-7-6-8-4-2-3-5-9(8)11(10)12(13)14/h2-7H,1H3,(H3,13,14)
InChIKeyRCIGPOBMYPKFBY-UHFFFAOYSA-N
XLogP2.13
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

Bunamidine
CID 13986
6-Methoxy-1-naphthalenemethanamine
CID 44352202
(6-Methoxynaphthalen-2-yl)methanamine
CID 16227396
N'-[(2-methoxyphenyl)methyl]naphthalene-2-carboximidamide
CID 20706441
7-Methoxy-8-(tetrahydro-furan-3-yl)-naphthalene-2-carboxamidine
CID 21706943
3-Iminobenzo[f]chromene-2-carbothioamide
CID 1210970
4-Methoxynaphthalen-1-ylmethylamine
CID 59139
(2-Methoxynaphthalen-1-yl)methanamine
CID 6483887
6-[2-(3-Isopropoxy-phenyl)-cyclopropyl]-naphthalene-2-carboxamidine
CID 44392427
3-[[5-[(3-Carbamimidoylphenoxy)methyl]naphthalen-1-yl]methoxy]benzenecarboximidamide
CID 45271080
4-[[5-[(4-Carbamimidoylphenoxy)methyl]naphthalen-1-yl]methoxy]benzenecarboximidamide
CID 45273756
3-[[5-[(3-Carbamimidoylphenyl)methoxy]naphthalen-1-yl]oxymethyl]benzenecarboximidamide;hydrochloride
CID 90643748

Frequently Asked Questions

What is the IUPAC name of 2-methoxynaphthalene-1-carboximidamide?
The IUPAC name of 2-methoxynaphthalene-1-carboximidamide (CID 5018470) is 2-methoxynaphthalene-1-carboximidamide.
What is the SMILES notation for 2-methoxynaphthalene-1-carboximidamide?
The canonical SMILES for 2-methoxynaphthalene-1-carboximidamide is [H]/N=C(\N)c1c(OC)ccc2ccccc12.
What is the InChIKey of 2-methoxynaphthalene-1-carboximidamide?
The InChIKey is RCIGPOBMYPKFBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-15-10-7-6-8-4-2-3-5-9(8)11(10)12(13)14/h2-7H,1H3,(H3,13,14).
What are the key properties of 2-methoxynaphthalene-1-carboximidamide?
2-methoxynaphthalene-1-carboximidamide has a molecular weight of 200.24 g/mol, XLogP of 2.13, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxynaphthalene-1-carboximidamide is sourced from PubChem (CID 5018470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).