N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine

C14H22N2O — CID 65182633

IUPACN-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine
SMILESc1nc(CCNC2CC2)oc1CC1CCCC1
InChIInChI=1S/C14H22N2O/c1-2-4-11(3-1)9-13-10-16-14(17-13)7-8-15-12-5-6-12/h10-12,15H,1-9H2
InChIKeyJDMJKKJFVBFLIY-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.70
Rot. Bonds6

About N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine

N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine (PubChem CID 65182633) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine
PubChem CID65182633
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine
SMILESc1nc(CCNC2CC2)oc1CC1CCCC1
InChIInChI=1S/C14H22N2O/c1-2-4-11(3-1)9-13-10-16-14(17-13)7-8-15-12-5-6-12/h10-12,15H,1-9H2
InChIKeyJDMJKKJFVBFLIY-UHFFFAOYSA-N
XLogP2.70
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[5-(cycloheptylmethyl)-1,3-oxazol-2-yl]propyl]cyclopropanamine
CID 114459249
N-[2-[5-(2-cyclopentylethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine
CID 65182303
2-(2-chloroethyl)-5-(cyclohexylmethyl)-1,3-oxazole
CID 65180053
2-[5-(cyclohexylmethyl)-1,3-oxazol-2-yl]ethanamine
CID 65178972
N-[2-[5-(cyclohexylmethyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-1-amine
CID 65182513
N-[3-[5-(cycloheptylmethyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-2-amine
CID 114459250
N-[2-[5-[2-(4-methylphenyl)ethyl]-1,3-oxazol-2-yl]ethyl]cyclopropanamine
CID 65182439
2-(chloromethyl)-5-(cycloheptylmethyl)-1,3-oxazole
CID 114459222
3-[5-(cyclobutylmethyl)-1,3-oxazol-2-yl]propan-1-amine
CID 103167128
N-[2-[5-(oxolan-2-yl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine
CID 65182395
N-[3-[5-(cyclopropylmethyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-2-amine
CID 65184883
N-[2-(1,3-oxazol-2-yl)ethyl]cyclopropanamine
CID 82467812

Frequently Asked Questions

What is the IUPAC name of N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine?
The IUPAC name of N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine (CID 65182633) is N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine.
What is the SMILES notation for N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine?
The canonical SMILES for N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine is c1nc(CCNC2CC2)oc1CC1CCCC1.
What is the InChIKey of N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine?
The InChIKey is JDMJKKJFVBFLIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-2-4-11(3-1)9-13-10-16-14(17-13)7-8-15-12-5-6-12/h10-12,15H,1-9H2.
What are the key properties of N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine?
N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine has a molecular weight of 234.34 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-(cyclopentylmethyl)-1,3-oxazol-2-yl]ethyl]cyclopropanamine is sourced from PubChem (CID 65182633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).