N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine

C14H22N4O — CID 66120101

IUPACN-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
SMILESCCn1nc(C)cc1-c1cnc(CCNC(C)C)o1
InChIInChI=1S/C14H22N4O/c1-5-18-12(8-11(4)17-18)13-9-16-14(19-13)6-7-15-10(2)3/h8-10,15H,5-7H2,1-4H3
InChIKeyFRUUQMNBEDJFDF-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.41
Rot. Bonds6

About N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine

N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine (PubChem CID 66120101) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
PubChem CID66120101
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
SMILESCCn1nc(C)cc1-c1cnc(CCNC(C)C)o1
InChIInChI=1S/C14H22N4O/c1-5-18-12(8-11(4)17-18)13-9-16-14(19-13)6-7-15-10(2)3/h8-10,15H,5-7H2,1-4H3
InChIKeyFRUUQMNBEDJFDF-UHFFFAOYSA-N
XLogP2.41
TPSA55.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine
CID 66120498
N-[3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propyl]cyclopropanamine
CID 66120698
3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]-N-(2-methoxyethyl)propan-1-amine
CID 66120896
N-[2-[5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
CID 66120641
N-[2-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
CID 65183522
N-[2-[5-(5-bromofuran-2-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
CID 65182190
N-[2-[5-(2-bromofuran-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
CID 106856309
2-(3-chloropropyl)-5-(2,5-dimethylpyrazol-3-yl)-1,3-oxazole
CID 66127379
N-[2-[5-(3-chloro-4-iodophenyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
CID 103213204
N-[2-(5-pyrazolo[1,5-a]pyridin-3-yl-1,3-oxazol-2-yl)ethyl]propan-2-amine
CID 103123445
3-[5-(4-bromo-2-chlorophenyl)-1,3-oxazol-2-yl]-N-propan-2-ylpropan-1-amine
CID 65187377
N-[2-(5-pyrazolo[1,5-a]pyrazin-3-yl-1,3-oxazol-2-yl)ethyl]propan-2-amine
CID 103123443

Frequently Asked Questions

What is the IUPAC name of N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine?
The IUPAC name of N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine (CID 66120101) is N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine.
What is the SMILES notation for N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine?
The canonical SMILES for N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine is CCn1nc(C)cc1-c1cnc(CCNC(C)C)o1.
What is the InChIKey of N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine?
The InChIKey is FRUUQMNBEDJFDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-5-18-12(8-11(4)17-18)13-9-16-14(19-13)6-7-15-10(2)3/h8-10,15H,5-7H2,1-4H3.
What are the key properties of N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine?
N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine has a molecular weight of 262.36 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine is sourced from PubChem (CID 66120101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).