N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine

C14H27N — CID 129269679

IUPACN-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine
SMILESC=C(CCC1C(C)C(C)C(C)C1C)NC
InChIInChI=1S/C14H27N/c1-9(15-6)7-8-14-12(4)10(2)11(3)13(14)5/h10-15H,1,7-8H2,2-6H3
InChIKeyGSEGYTZGJNGIRC-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.67
Rot. Bonds4

About N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine

N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine (PubChem CID 129269679) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine.

Molecular Properties

Compound NameN-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine
PubChem CID129269679
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine
SMILESC=C(CCC1C(C)C(C)C(C)C1C)NC
InChIInChI=1S/C14H27N/c1-9(15-6)7-8-14-12(4)10(2)11(3)13(14)5/h10-15H,1,7-8H2,2-6H3
InChIKeyGSEGYTZGJNGIRC-UHFFFAOYSA-N
XLogP3.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine?
The IUPAC name of N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine (CID 129269679) is N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine.
What is the SMILES notation for N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine?
The canonical SMILES for N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine is C=C(CCC1C(C)C(C)C(C)C1C)NC.
What is the InChIKey of N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine?
The InChIKey is GSEGYTZGJNGIRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-9(15-6)7-8-14-12(4)10(2)11(3)13(14)5/h10-15H,1,7-8H2,2-6H3.
What are the key properties of N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine?
N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine has a molecular weight of 209.38 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(2,3,4,5-tetramethylcyclopentyl)but-1-en-2-amine is sourced from PubChem (CID 129269679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).