1-aminocyclopentane-1-carboximidamide

C6H13N3 — CID 75356225

IUPAC1-aminocyclopentane-1-carboximidamide
SMILES[H]/N=C(\N)C1(N)CCCC1
InChIInChI=1S/C6H13N3/c7-5(8)6(9)3-1-2-4-6/h1-4,9H2,(H3,7,8)
InChIKeyFGOWKAABTZTLMP-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.19
Rot. Bonds1

About 1-aminocyclopentane-1-carboximidamide

1-aminocyclopentane-1-carboximidamide (PubChem CID 75356225) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is 1-aminocyclopentane-1-carboximidamide.

Molecular Properties

Compound Name1-aminocyclopentane-1-carboximidamide
PubChem CID75356225
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC Name1-aminocyclopentane-1-carboximidamide
SMILES[H]/N=C(\N)C1(N)CCCC1
InChIInChI=1S/C6H13N3/c7-5(8)6(9)3-1-2-4-6/h1-4,9H2,(H3,7,8)
InChIKeyFGOWKAABTZTLMP-UHFFFAOYSA-N
XLogP0.19
TPSA75.89 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.19
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 1-aminocyclopentane-1-carboximidamide?
The IUPAC name of 1-aminocyclopentane-1-carboximidamide (CID 75356225) is 1-aminocyclopentane-1-carboximidamide.
What is the SMILES notation for 1-aminocyclopentane-1-carboximidamide?
The canonical SMILES for 1-aminocyclopentane-1-carboximidamide is [H]/N=C(\N)C1(N)CCCC1.
What is the InChIKey of 1-aminocyclopentane-1-carboximidamide?
The InChIKey is FGOWKAABTZTLMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3/c7-5(8)6(9)3-1-2-4-6/h1-4,9H2,(H3,7,8).
What are the key properties of 1-aminocyclopentane-1-carboximidamide?
1-aminocyclopentane-1-carboximidamide has a molecular weight of 127.19 g/mol, XLogP of 0.19, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminocyclopentane-1-carboximidamide is sourced from PubChem (CID 75356225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).