N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine

C12H21NO — CID 115895899

IUPACN-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine
SMILESCC1OCCC1NCCC1=CCCC1
InChIInChI=1S/C12H21NO/c1-10-12(7-9-14-10)13-8-6-11-4-2-3-5-11/h4,10,12-13H,2-3,5-9H2,1H3
InChIKeyJDZDVOILFNVLRB-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.25
Rot. Bonds4

About N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine

N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine (PubChem CID 115895899) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine.

Molecular Properties

Compound NameN-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine
PubChem CID115895899
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC NameN-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine
SMILESCC1OCCC1NCCC1=CCCC1
InChIInChI=1S/C12H21NO/c1-10-12(7-9-14-10)13-8-6-11-4-2-3-5-11/h4,10,12-13H,2-3,5-9H2,1H3
InChIKeyJDZDVOILFNVLRB-UHFFFAOYSA-N
XLogP2.25
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

cis-(1S,2R)-N-[2-(cyclohexen-1-yl)ethyl]-2-methylcyclopentan-1-amine
CID 97030527
N-[2-(cyclohexen-1-yl)ethyl]-2-methylcyclohexan-1-amine
CID 43078509
2-[2-(cyclopenten-1-yl)ethylamino]cyclobutane-1-carboxylic acid
CID 106178034
2-cyclohexyl-N-[2-(cyclopenten-1-yl)ethyl]cyclohexan-1-amine
CID 106169105
2-[2-(cyclohexen-1-yl)ethylamino]cyclopentan-1-ol
CID 60713815
N-[2-(cyclopenten-1-yl)ethyl]-1-azabicyclo[2.2.2]octan-3-amine
CID 106169922
N-[2-(4-chlorophenyl)ethyl]-2-methyloxolan-3-amine
CID 115335523
N-[2-(cyclopenten-1-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 106170204
N-[2-(cyclohexen-1-yl)ethyl]oxolan-3-amine
CID 63331729
N-[2-(cyclopenten-1-yl)ethyl]-2,2-dimethylcyclopentan-1-amine
CID 115895909
N-[2-(cyclopenten-1-yl)ethyl]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 106170157
N-[2-(cyclohexen-1-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
CID 61308957

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine?
The IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine (CID 115895899) is N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine.
What is the SMILES notation for N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine?
The canonical SMILES for N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine is CC1OCCC1NCCC1=CCCC1.
What is the InChIKey of N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine?
The InChIKey is JDZDVOILFNVLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-10-12(7-9-14-10)13-8-6-11-4-2-3-5-11/h4,10,12-13H,2-3,5-9H2,1H3.
What are the key properties of N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine?
N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine has a molecular weight of 195.31 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopenten-1-yl)ethyl]-2-methyloxolan-3-amine is sourced from PubChem (CID 115895899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).