N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide

C11H19N3 — CID 164652475

IUPACN-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide
SMILESNN/C(=N\C1CC1)C1CC2(CCC2)C1
InChIInChI=1S/C11H19N3/c12-14-10(13-9-2-3-9)8-6-11(7-8)4-1-5-11/h8-9H,1-7,12H2,(H,13,14)
InChIKeySCKFLFGEGIYMIB-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.59
Rot. Bonds2

About N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide

N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide (PubChem CID 164652475) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide.

Molecular Properties

Compound NameN-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide
PubChem CID164652475
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide
SMILESNN/C(=N\C1CC1)C1CC2(CCC2)C1
InChIInChI=1S/C11H19N3/c12-14-10(13-9-2-3-9)8-6-11(7-8)4-1-5-11/h8-9H,1-7,12H2,(H,13,14)
InChIKeySCKFLFGEGIYMIB-UHFFFAOYSA-N
XLogP1.59
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.59
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'-cyclopropylspiro[3.3]heptane-2-carboximidamide?
The IUPAC name of N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide (CID 164652475) is N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide.
What is the SMILES notation for N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide?
The canonical SMILES for N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide is NN/C(=N\C1CC1)C1CC2(CCC2)C1.
What is the InChIKey of N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide?
The InChIKey is SCKFLFGEGIYMIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c12-14-10(13-9-2-3-9)8-6-11(7-8)4-1-5-11/h8-9H,1-7,12H2,(H,13,14).
What are the key properties of N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide?
N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide has a molecular weight of 193.29 g/mol, XLogP of 1.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-cyclopropylspiro[3.3]heptane-2-carboximidamide is sourced from PubChem (CID 164652475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).