2-methyl-N'-propylcyclopentane-1-carboximidamide

C10H20N2 — CID 130757878

IUPAC2-methyl-N'-propylcyclopentane-1-carboximidamide
SMILESCCC/N=C(\N)C1CCCC1C
InChIInChI=1S/C10H20N2/c1-3-7-12-10(11)9-6-4-5-8(9)2/h8-9H,3-7H2,1-2H3,(H2,11,12)
InChIKeyPMNRMUKQLAAGJI-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.19
Rot. Bonds3

About 2-methyl-N'-propylcyclopentane-1-carboximidamide

2-methyl-N'-propylcyclopentane-1-carboximidamide (PubChem CID 130757878) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-methyl-N'-propylcyclopentane-1-carboximidamide.

Molecular Properties

Compound Name2-methyl-N'-propylcyclopentane-1-carboximidamide
PubChem CID130757878
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name2-methyl-N'-propylcyclopentane-1-carboximidamide
SMILESCCC/N=C(\N)C1CCCC1C
InChIInChI=1S/C10H20N2/c1-3-7-12-10(11)9-6-4-5-8(9)2/h8-9H,3-7H2,1-2H3,(H2,11,12)
InChIKeyPMNRMUKQLAAGJI-UHFFFAOYSA-N
XLogP2.19
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 2-methyl-N'-propylcyclopentane-1-carboximidamide?
The IUPAC name of 2-methyl-N'-propylcyclopentane-1-carboximidamide (CID 130757878) is 2-methyl-N'-propylcyclopentane-1-carboximidamide.
What is the SMILES notation for 2-methyl-N'-propylcyclopentane-1-carboximidamide?
The canonical SMILES for 2-methyl-N'-propylcyclopentane-1-carboximidamide is CCC/N=C(\N)C1CCCC1C.
What is the InChIKey of 2-methyl-N'-propylcyclopentane-1-carboximidamide?
The InChIKey is PMNRMUKQLAAGJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-7-12-10(11)9-6-4-5-8(9)2/h8-9H,3-7H2,1-2H3,(H2,11,12).
What are the key properties of 2-methyl-N'-propylcyclopentane-1-carboximidamide?
2-methyl-N'-propylcyclopentane-1-carboximidamide has a molecular weight of 168.28 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-propylcyclopentane-1-carboximidamide is sourced from PubChem (CID 130757878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).