2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol

C13H21NO2 — CID 115907721

IUPAC2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol
SMILESCc1ccc(C(O)CNCC2CCCC2)o1
InChIInChI=1S/C13H21NO2/c1-10-6-7-13(16-10)12(15)9-14-8-11-4-2-3-5-11/h6-7,11-12,14-15H,2-5,8-9H2,1H3
InChIKeyKSDDZQJDEVTDBH-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.40
Rot. Bonds5

About 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol

2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol (PubChem CID 115907721) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol.

Molecular Properties

Compound Name2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol
PubChem CID115907721
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol
SMILESCc1ccc(C(O)CNCC2CCCC2)o1
InChIInChI=1S/C13H21NO2/c1-10-6-7-13(16-10)12(15)9-14-8-11-4-2-3-5-11/h6-7,11-12,14-15H,2-5,8-9H2,1H3
InChIKeyKSDDZQJDEVTDBH-UHFFFAOYSA-N
XLogP2.40
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,2-dimethylpropylamino)-1-(5-methylfuran-2-yl)ethanol
CID 115646640
2-(1-cyclopropylethylamino)-1-(5-methylfuran-2-yl)ethanol
CID 115677292
1-cyclopentyl-3-[1-(5-methylfuran-2-yl)ethylamino]propan-2-ol
CID 103157408
N-(cyclobutylmethyl)-1-(5-methylfuran-2-yl)ethanamine
CID 43298426
1-(5-methylfuran-2-yl)-2-(oxolan-3-ylamino)ethanol
CID 115689533
N-(cyclopentylmethyl)-2,2-diphenylethanamine
CID 107292721
1-(5-methylfuran-2-yl)propan-1-ol
CID 14570731
tert-butyl N-[2-hydroxy-2-(5-methylfuran-2-yl)ethyl]carbamate
CID 116861139
1-(5-methylfuran-2-yl)-2-[[(1R,5S)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]amino]ethanol
CID 166304176
1-(5-methylfuran-2-yl)-2-(thiadiazol-4-ylmethylamino)ethanol
CID 115907720
2-(1-ethoxypropan-2-ylamino)-1-(5-methylfuran-2-yl)ethanol
CID 115723342
(1S)-2-(cycloheptylmethylamino)-1-(3,4-difluorophenyl)ethanol
CID 95972210

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol?
The IUPAC name of 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol (CID 115907721) is 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol.
What is the SMILES notation for 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol?
The canonical SMILES for 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol is Cc1ccc(C(O)CNCC2CCCC2)o1.
What is the InChIKey of 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol?
The InChIKey is KSDDZQJDEVTDBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-10-6-7-13(16-10)12(15)9-14-8-11-4-2-3-5-11/h6-7,11-12,14-15H,2-5,8-9H2,1H3.
What are the key properties of 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol?
2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol has a molecular weight of 223.32 g/mol, XLogP of 2.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethylamino)-1-(5-methylfuran-2-yl)ethanol is sourced from PubChem (CID 115907721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).