N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine

C12H20N2O — CID 79237126

IUPACN-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine
SMILESCc1noc(C)c1C(C)NC1CCCC1
InChIInChI=1S/C12H20N2O/c1-8(13-11-6-4-5-7-11)12-9(2)14-15-10(12)3/h8,11,13H,4-7H2,1-3H3
InChIKeySBEHTRDLSQEBGS-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.88
Rot. Bonds3

About N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine

N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine (PubChem CID 79237126) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine.

Molecular Properties

Compound NameN-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine
PubChem CID79237126
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC NameN-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine
SMILESCc1noc(C)c1C(C)NC1CCCC1
InChIInChI=1S/C12H20N2O/c1-8(13-11-6-4-5-7-11)12-9(2)14-15-10(12)3/h8,11,13H,4-7H2,1-3H3
InChIKeySBEHTRDLSQEBGS-UHFFFAOYSA-N
XLogP2.88
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-propan-2-ylcyclohexan-1-amine
CID 107448603
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-(2-methylpropyl)cyclohexan-1-amine
CID 107428578
3-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentane-1,3-diamine
CID 79462313
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3,3,5,5-tetramethylcyclohexan-1-amine
CID 115998955
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclohex-2-en-1-amine
CID 104577646
N-(dicyclopropylmethyl)-1-(3,5-dimethyl-1,2-oxazol-4-yl)ethanamine
CID 79237238
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)propan-2-yl]cyclopentanamine
CID 115722279
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2,6-dioxaspiro[4.5]decan-9-amine
CID 79903316
tert-butyl 3-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethylamino]pyrrolidine-1-carboxylate
CID 103820989
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-(3-methylphenyl)cyclobutan-1-amine
CID 79231071
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
CID 79236127
(2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide
CID 103811457

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine?
The IUPAC name of N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine (CID 79237126) is N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine.
What is the SMILES notation for N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine?
The canonical SMILES for N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine is Cc1noc(C)c1C(C)NC1CCCC1.
What is the InChIKey of N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine?
The InChIKey is SBEHTRDLSQEBGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-8(13-11-6-4-5-7-11)12-9(2)14-15-10(12)3/h8,11,13H,4-7H2,1-3H3.
What are the key properties of N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine?
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine has a molecular weight of 208.30 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]cyclopentanamine is sourced from PubChem (CID 79237126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).