N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine

C14H26N2 — CID 106169606

IUPACN-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
SMILESCC(CC1CCCN1)NCCC1=CCCC1
InChIInChI=1S/C14H26N2/c1-12(11-14-7-4-9-16-14)15-10-8-13-5-2-3-6-13/h5,12,14-16H,2-4,6-11H2,1H3
InChIKeyQHGCBHKPNKYCGH-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.61
Rot. Bonds6

About N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine

N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine (PubChem CID 106169606) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
PubChem CID106169606
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
SMILESCC(CC1CCCN1)NCCC1=CCCC1
InChIInChI=1S/C14H26N2/c1-12(11-14-7-4-9-16-14)15-10-8-13-5-2-3-6-13/h5,12,14-16H,2-4,6-11H2,1H3
InChIKeyQHGCBHKPNKYCGH-UHFFFAOYSA-N
XLogP2.61
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine?
The IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine (CID 106169606) is N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine.
What is the SMILES notation for N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine?
The canonical SMILES for N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine is CC(CC1CCCN1)NCCC1=CCCC1.
What is the InChIKey of N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine?
The InChIKey is QHGCBHKPNKYCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-12(11-14-7-4-9-16-14)15-10-8-13-5-2-3-6-13/h5,12,14-16H,2-4,6-11H2,1H3.
What are the key properties of N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine?
N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine has a molecular weight of 222.38 g/mol, XLogP of 2.61, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopenten-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine is sourced from PubChem (CID 106169606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).