1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol

C15H27NO2 — CID 103580894

IUPAC1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol
SMILESOC(CNC1CCOC1C1CC1)CC1CCCC1
InChIInChI=1S/C15H27NO2/c17-13(9-11-3-1-2-4-11)10-16-14-7-8-18-15(14)12-5-6-12/h11-17H,1-10H2
InChIKeyDNJLCQJDAFLORD-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.08
Rot. Bonds6

About 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol

1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol (PubChem CID 103580894) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol
PubChem CID103580894
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol
SMILESOC(CNC1CCOC1C1CC1)CC1CCCC1
InChIInChI=1S/C15H27NO2/c17-13(9-11-3-1-2-4-11)10-16-14-7-8-18-15(14)12-5-6-12/h11-17H,1-10H2
InChIKeyDNJLCQJDAFLORD-UHFFFAOYSA-N
XLogP2.08
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol?
The IUPAC name of 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol (CID 103580894) is 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol is OC(CNC1CCOC1C1CC1)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol?
The InChIKey is DNJLCQJDAFLORD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c17-13(9-11-3-1-2-4-11)10-16-14-7-8-18-15(14)12-5-6-12/h11-17H,1-10H2.
What are the key properties of 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol?
1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol has a molecular weight of 253.39 g/mol, XLogP of 2.08, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[(2-cyclopropyloxolan-3-yl)amino]propan-2-ol is sourced from PubChem (CID 103580894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).