2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol

C14H28N2O — CID 117237131

IUPAC2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol
SMILESCC(C)N1CCC(C(O)CNC2CCCC2)C1
InChIInChI=1S/C14H28N2O/c1-11(2)16-8-7-12(10-16)14(17)9-15-13-5-3-4-6-13/h11-15,17H,3-10H2,1-2H3
InChIKeyYDPACEPNFNQJEL-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.61
Rot. Bonds5

About 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol

2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol (PubChem CID 117237131) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol.

Molecular Properties

Compound Name2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol
PubChem CID117237131
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol
SMILESCC(C)N1CCC(C(O)CNC2CCCC2)C1
InChIInChI=1S/C14H28N2O/c1-11(2)16-8-7-12(10-16)14(17)9-15-13-5-3-4-6-13/h11-15,17H,3-10H2,1-2H3
InChIKeyYDPACEPNFNQJEL-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol?
The IUPAC name of 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol (CID 117237131) is 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol.
What is the SMILES notation for 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol?
The canonical SMILES for 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol is CC(C)N1CCC(C(O)CNC2CCCC2)C1.
What is the InChIKey of 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol?
The InChIKey is YDPACEPNFNQJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11(2)16-8-7-12(10-16)14(17)9-15-13-5-3-4-6-13/h11-15,17H,3-10H2,1-2H3.
What are the key properties of 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol?
2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol has a molecular weight of 240.39 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-1-(1-propan-2-ylpyrrolidin-3-yl)ethanol is sourced from PubChem (CID 117237131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).