N'-amino-1,2-dimethylindole-3-carboximidamide

C11H14N4 — CID 83532039

IUPACN'-amino-1,2-dimethylindole-3-carboximidamide
SMILESCc1c(/C(N)=N/N)c2ccccc2n1C
InChIInChI=1S/C11H14N4/c1-7-10(11(12)14-13)8-5-3-4-6-9(8)15(7)2/h3-6H,13H2,1-2H3,(H2,12,14)
InChIKeyIYGMAXQOKVQTRY-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.07
Rot. Bonds1

About N'-amino-1,2-dimethylindole-3-carboximidamide

N'-amino-1,2-dimethylindole-3-carboximidamide (PubChem CID 83532039) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is N'-amino-1,2-dimethylindole-3-carboximidamide.

Molecular Properties

Compound NameN'-amino-1,2-dimethylindole-3-carboximidamide
PubChem CID83532039
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC NameN'-amino-1,2-dimethylindole-3-carboximidamide
SMILESCc1c(/C(N)=N/N)c2ccccc2n1C
InChIInChI=1S/C11H14N4/c1-7-10(11(12)14-13)8-5-3-4-6-9(8)15(7)2/h3-6H,13H2,1-2H3,(H2,12,14)
InChIKeyIYGMAXQOKVQTRY-UHFFFAOYSA-N
XLogP1.07
TPSA69.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

(1,2-dimethylindol-3-yl)-(1-methylindol-3-yl)methanone
CID 23544603
(1E)-1-(1,2-dimethylindol-3-yl)buta-1,3-dien-2-amine
CID 163942685
ethane;1,2,3-trimethylindole
CID 91590745
1-(1,2-dimethylindol-3-yl)-2-(methylamino)butan-1-one
CID 82294421
2-(1,2-dimethylindol-3-yl)propanamide
CID 20667705
2-(1,2-dimethylindol-3-yl)acetamide
CID 67627690
2-chloro-5-(1,2-dimethylindole-3-carbonyl)benzenesulfonamide
CID 21316638
4-(1,2-dimethylindole-3-carbonyl)-2-methylmorpholine-2-carboxamide
CID 110268334
1-(1,2-dimethylindol-3-yl)-2-pyrrolidin-1-ylethane-1,2-dione
CID 7087146
4-(1,2-dimethylindole-3-carbonyl)-N,N-dimethylpiperazine-1-sulfonamide
CID 110805060
3-iodo-1,2-dimethylindole
CID 19093282
1-(1,2-dimethylindol-3-yl)-3-methyl-2-(methylamino)butan-1-one
CID 82300709

Frequently Asked Questions

What is the IUPAC name of N'-amino-1,2-dimethylindole-3-carboximidamide?
The IUPAC name of N'-amino-1,2-dimethylindole-3-carboximidamide (CID 83532039) is N'-amino-1,2-dimethylindole-3-carboximidamide.
What is the SMILES notation for N'-amino-1,2-dimethylindole-3-carboximidamide?
The canonical SMILES for N'-amino-1,2-dimethylindole-3-carboximidamide is Cc1c(/C(N)=N/N)c2ccccc2n1C.
What is the InChIKey of N'-amino-1,2-dimethylindole-3-carboximidamide?
The InChIKey is IYGMAXQOKVQTRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1-7-10(11(12)14-13)8-5-3-4-6-9(8)15(7)2/h3-6H,13H2,1-2H3,(H2,12,14).
What are the key properties of N'-amino-1,2-dimethylindole-3-carboximidamide?
N'-amino-1,2-dimethylindole-3-carboximidamide has a molecular weight of 202.26 g/mol, XLogP of 1.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-1,2-dimethylindole-3-carboximidamide is sourced from PubChem (CID 83532039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).