2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine

C16H25N — CID 63476548

IUPAC2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine
SMILESCc1cc(C)c(C(C)NC2CC2(C)C)c(C)c1
InChIInChI=1S/C16H25N/c1-10-7-11(2)15(12(3)8-10)13(4)17-14-9-16(14,5)6/h7-8,13-14,17H,9H2,1-6H3
InChIKeyOPEPZPCDBORKRQ-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.06
Rot. Bonds3

About 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine

2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine (PubChem CID 63476548) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine
PubChem CID63476548
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine
SMILESCc1cc(C)c(C(C)NC2CC2(C)C)c(C)c1
InChIInChI=1S/C16H25N/c1-10-7-11(2)15(12(3)8-10)13(4)17-14-9-16(14,5)6/h7-8,13-14,17H,9H2,1-6H3
InChIKeyOPEPZPCDBORKRQ-UHFFFAOYSA-N
XLogP4.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine?
The IUPAC name of 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine (CID 63476548) is 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine is Cc1cc(C)c(C(C)NC2CC2(C)C)c(C)c1.
What is the InChIKey of 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine?
The InChIKey is OPEPZPCDBORKRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-10-7-11(2)15(12(3)8-10)13(4)17-14-9-16(14,5)6/h7-8,13-14,17H,9H2,1-6H3.
What are the key properties of 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine?
2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine has a molecular weight of 231.38 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[1-(2,4,6-trimethylphenyl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 63476548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).