3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide

C11H22N2 — CID 65414057

IUPAC3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide
SMILESCC(C)C/N=C(\N)C1CCC(C)C1
InChIInChI=1S/C11H22N2/c1-8(2)7-13-11(12)10-5-4-9(3)6-10/h8-10H,4-7H2,1-3H3,(H2,12,13)
InChIKeyKXVVSDXGLNSCNN-UHFFFAOYSA-N
MW182.31 g/mol
LogP2.44
Rot. Bonds3

About 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide

3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide (PubChem CID 65414057) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide.

Molecular Properties

Compound Name3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide
PubChem CID65414057
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide
SMILESCC(C)C/N=C(\N)C1CCC(C)C1
InChIInChI=1S/C11H22N2/c1-8(2)7-13-11(12)10-5-4-9(3)6-10/h8-10H,4-7H2,1-3H3,(H2,12,13)
InChIKeyKXVVSDXGLNSCNN-UHFFFAOYSA-N
XLogP2.44
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.44
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 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide?
The IUPAC name of 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide (CID 65414057) is 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide.
What is the SMILES notation for 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide?
The canonical SMILES for 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide is CC(C)C/N=C(\N)C1CCC(C)C1.
What is the InChIKey of 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide?
The InChIKey is KXVVSDXGLNSCNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-8(2)7-13-11(12)10-5-4-9(3)6-10/h8-10H,4-7H2,1-3H3,(H2,12,13).
What are the key properties of 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide?
3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide has a molecular weight of 182.31 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N'-(2-methylpropyl)cyclopentane-1-carboximidamide is sourced from PubChem (CID 65414057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).