N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine

C13H25N — CID 62723939

IUPACN-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine
SMILESCC(C)(CNC1CC1)CC1CCCC1
InChIInChI=1S/C13H25N/c1-13(2,10-14-12-7-8-12)9-11-5-3-4-6-11/h11-12,14H,3-10H2,1-2H3
InChIKeyQYUIBEKFURZNKC-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.34
Rot. Bonds5

About N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine

N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine (PubChem CID 62723939) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine.

Molecular Properties

Compound NameN-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine
PubChem CID62723939
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine
SMILESCC(C)(CNC1CC1)CC1CCCC1
InChIInChI=1S/C13H25N/c1-13(2,10-14-12-7-8-12)9-11-5-3-4-6-11/h11-12,14H,3-10H2,1-2H3
InChIKeyQYUIBEKFURZNKC-UHFFFAOYSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine?
The IUPAC name of N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine (CID 62723939) is N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine.
What is the SMILES notation for N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine?
The canonical SMILES for N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine is CC(C)(CNC1CC1)CC1CCCC1.
What is the InChIKey of N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine?
The InChIKey is QYUIBEKFURZNKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-13(2,10-14-12-7-8-12)9-11-5-3-4-6-11/h11-12,14H,3-10H2,1-2H3.
What are the key properties of N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine?
N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine has a molecular weight of 195.35 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyl-2,2-dimethylpropyl)cyclopropanamine is sourced from PubChem (CID 62723939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).