N-amino-N'-tert-butylnaphthalene-1-carboximidamide

C15H19N3 — CID 61362122

IUPACN-amino-N'-tert-butylnaphthalene-1-carboximidamide
SMILESCC(C)(C)/N=C(\NN)c1cccc2ccccc12
InChIInChI=1S/C15H19N3/c1-15(2,3)17-14(18-16)13-10-6-8-11-7-4-5-9-12(11)13/h4-10H,16H2,1-3H3,(H,17,18)
InChIKeyGHOMSQHTWKXKSJ-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.85
Rot. Bonds1

About N-amino-N'-tert-butylnaphthalene-1-carboximidamide

N-amino-N'-tert-butylnaphthalene-1-carboximidamide (PubChem CID 61362122) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-amino-N'-tert-butylnaphthalene-1-carboximidamide.

Molecular Properties

Compound NameN-amino-N'-tert-butylnaphthalene-1-carboximidamide
PubChem CID61362122
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-amino-N'-tert-butylnaphthalene-1-carboximidamide
SMILESCC(C)(C)/N=C(\NN)c1cccc2ccccc12
InChIInChI=1S/C15H19N3/c1-15(2,3)17-14(18-16)13-10-6-8-11-7-4-5-9-12(11)13/h4-10H,16H2,1-3H3,(H,17,18)
InChIKeyGHOMSQHTWKXKSJ-UHFFFAOYSA-N
XLogP2.85
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-amino-N'-tert-butyl-1-benzothiophene-2-carboximidamide
CID 61406895
N-amino-N'-tert-butyl-5-fluoro-2-methylbenzenecarboximidamide
CID 63048983
N-(1-amino-2-methylpropan-2-yl)naphthalene-1-carboxamide;hydrochloride
CID 119522938
N-methyl-2-naphthalen-1-ylprop-2-en-1-imine
CID 139239744
2-(4-tert-butylphenyl)-N-methyl-1-naphthalen-1-ylethanimine
CID 87746806
N,N'-bis(4-methylphenyl)naphthalene-1-carboximidamide
CID 3345579
N-(dinaphthalen-1-ylmethylidene)hydroxylamine
CID 88653107
1-naphthalen-1-ylethylidenezirconium(2+)
CID 158619381
2-tert-butylsulfanyl-1-naphthalen-1-ylethanone
CID 60645589
CID 102208465
CID 102208465
azane;1-prop-1-en-2-ylnaphthalene
CID 122612227
CID 129133768
CID 129133768

Frequently Asked Questions

What is the IUPAC name of N-amino-N'-tert-butylnaphthalene-1-carboximidamide?
The IUPAC name of N-amino-N'-tert-butylnaphthalene-1-carboximidamide (CID 61362122) is N-amino-N'-tert-butylnaphthalene-1-carboximidamide.
What is the SMILES notation for N-amino-N'-tert-butylnaphthalene-1-carboximidamide?
The canonical SMILES for N-amino-N'-tert-butylnaphthalene-1-carboximidamide is CC(C)(C)/N=C(\NN)c1cccc2ccccc12.
What is the InChIKey of N-amino-N'-tert-butylnaphthalene-1-carboximidamide?
The InChIKey is GHOMSQHTWKXKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-15(2,3)17-14(18-16)13-10-6-8-11-7-4-5-9-12(11)13/h4-10H,16H2,1-3H3,(H,17,18).
What are the key properties of N-amino-N'-tert-butylnaphthalene-1-carboximidamide?
N-amino-N'-tert-butylnaphthalene-1-carboximidamide has a molecular weight of 241.34 g/mol, XLogP of 2.85, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-tert-butylnaphthalene-1-carboximidamide is sourced from PubChem (CID 61362122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).