N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine

C14H25N — CID 58570427

IUPACN-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine
SMILESCC1=C(C)C(C(C)(C)NC(C)C)=C(C)C1
InChIInChI=1S/C14H25N/c1-9(2)15-14(6,7)13-11(4)8-10(3)12(13)5/h9,15H,8H2,1-7H3
InChIKeyQGLMDYJJRSXENX-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.82
Rot. Bonds3

About N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine

N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine (PubChem CID 58570427) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine
PubChem CID58570427
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine
SMILESCC1=C(C)C(C(C)(C)NC(C)C)=C(C)C1
InChIInChI=1S/C14H25N/c1-9(2)15-14(6,7)13-11(4)8-10(3)12(13)5/h9,15H,8H2,1-7H3
InChIKeyQGLMDYJJRSXENX-UHFFFAOYSA-N
XLogP3.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine?
The IUPAC name of N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine (CID 58570427) is N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine.
What is the SMILES notation for N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine?
The canonical SMILES for N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine is CC1=C(C)C(C(C)(C)NC(C)C)=C(C)C1.
What is the InChIKey of N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine?
The InChIKey is QGLMDYJJRSXENX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-9(2)15-14(6,7)13-11(4)8-10(3)12(13)5/h9,15H,8H2,1-7H3.
What are the key properties of N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine?
N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine has a molecular weight of 207.36 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-(2,4,5-trimethylcyclopenta-1,4-dien-1-yl)propan-2-amine is sourced from PubChem (CID 58570427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).