2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine

C12H26N2 — CID 79569791

IUPAC2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine
SMILESCCN(CCC1CCCC1N)C(C)C
InChIInChI=1S/C12H26N2/c1-4-14(10(2)3)9-8-11-6-5-7-12(11)13/h10-12H,4-9,13H2,1-3H3
InChIKeyHNJHPIZWHNEDBX-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.23
Rot. Bonds5

About 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine

2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine (PubChem CID 79569791) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine
PubChem CID79569791
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine
SMILESCCN(CCC1CCCC1N)C(C)C
InChIInChI=1S/C12H26N2/c1-4-14(10(2)3)9-8-11-6-5-7-12(11)13/h10-12H,4-9,13H2,1-3H3
InChIKeyHNJHPIZWHNEDBX-UHFFFAOYSA-N
XLogP2.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine?
The IUPAC name of 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine (CID 79569791) is 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine is CCN(CCC1CCCC1N)C(C)C.
What is the InChIKey of 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine?
The InChIKey is HNJHPIZWHNEDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-4-14(10(2)3)9-8-11-6-5-7-12(11)13/h10-12H,4-9,13H2,1-3H3.
What are the key properties of 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine?
2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine has a molecular weight of 198.35 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine is sourced from PubChem (CID 79569791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).