N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine

C10H17N — CID 15775951

IUPACN-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine
SMILESCC(C)NCCC1C=CC=C1
InChIInChI=1S/C10H17N/c1-9(2)11-8-7-10-5-3-4-6-10/h3-6,9-11H,7-8H2,1-2H3
InChIKeyLZSILLRVVBNLGQ-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.12
Rot. Bonds4

About N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine

N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine (PubChem CID 15775951) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine.

Molecular Properties

Compound NameN-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine
PubChem CID15775951
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine
SMILESCC(C)NCCC1C=CC=C1
InChIInChI=1S/C10H17N/c1-9(2)11-8-7-10-5-3-4-6-10/h3-6,9-11H,7-8H2,1-2H3
InChIKeyLZSILLRVVBNLGQ-UHFFFAOYSA-N
XLogP2.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine?
The IUPAC name of N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine (CID 15775951) is N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine.
What is the SMILES notation for N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine?
The canonical SMILES for N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine is CC(C)NCCC1C=CC=C1.
What is the InChIKey of N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine?
The InChIKey is LZSILLRVVBNLGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-9(2)11-8-7-10-5-3-4-6-10/h3-6,9-11H,7-8H2,1-2H3.
What are the key properties of N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine?
N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine has a molecular weight of 151.25 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopenta-2,4-dien-1-ylethyl)propan-2-amine is sourced from PubChem (CID 15775951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).