N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide

C11H21N3 — CID 106828793

IUPACN-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide
SMILESCC1(/C(=N/C2CC2)NN)CCCCC1
InChIInChI=1S/C11H21N3/c1-11(7-3-2-4-8-11)10(14-12)13-9-5-6-9/h9H,2-8,12H2,1H3,(H,13,14)
InChIKeyUAEFPTFIWKDYGO-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.98
Rot. Bonds2

About N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide

N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide (PubChem CID 106828793) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide.

Molecular Properties

Compound NameN-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide
PubChem CID106828793
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC NameN-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide
SMILESCC1(/C(=N/C2CC2)NN)CCCCC1
InChIInChI=1S/C11H21N3/c1-11(7-3-2-4-8-11)10(14-12)13-9-5-6-9/h9H,2-8,12H2,1H3,(H,13,14)
InChIKeyUAEFPTFIWKDYGO-UHFFFAOYSA-N
XLogP1.98
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.98
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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Frequently Asked Questions

What is the IUPAC name of N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide?
The IUPAC name of N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide (CID 106828793) is N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide.
What is the SMILES notation for N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide?
The canonical SMILES for N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide is CC1(/C(=N/C2CC2)NN)CCCCC1.
What is the InChIKey of N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide?
The InChIKey is UAEFPTFIWKDYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-11(7-3-2-4-8-11)10(14-12)13-9-5-6-9/h9H,2-8,12H2,1H3,(H,13,14).
What are the key properties of N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide?
N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide has a molecular weight of 195.31 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-cyclopropyl-1-methylcyclohexane-1-carboximidamide is sourced from PubChem (CID 106828793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).