1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine

C13H21N5O — CID 75507091

IUPAC1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine
SMILESCC(C)c1noc(C(C)Nc2cnn(C(C)C)c2)n1
InChIInChI=1S/C13H21N5O/c1-8(2)12-16-13(19-17-12)10(5)15-11-6-14-18(7-11)9(3)4/h6-10,15H,1-5H3
InChIKeyKDOKLUVZRWQKFX-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.14
Rot. Bonds5

About 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine

1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine (PubChem CID 75507091) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine
PubChem CID75507091
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC Name1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine
SMILESCC(C)c1noc(C(C)Nc2cnn(C(C)C)c2)n1
InChIInChI=1S/C13H21N5O/c1-8(2)12-16-13(19-17-12)10(5)15-11-6-14-18(7-11)9(3)4/h6-10,15H,1-5H3
InChIKeyKDOKLUVZRWQKFX-UHFFFAOYSA-N
XLogP3.14
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-N-[4-[[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]amino]phenyl]acetamide
CID 95236398
N-[4-[[(1R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]amino]phenyl]methanesulfonamide
CID 94113861
N-[1-(4-methylphenyl)ethyl]-1-propan-2-ylpyrazol-4-amine
CID 62902276
4-phenoxy-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]aniline
CID 34273923
1-(2,2-difluoroethyl)-N-[(1R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine
CID 99822995
1-propan-2-yl-N-[1-(4-propylphenyl)ethyl]pyrazol-4-amine
CID 62903879
N-[1-(4-tert-butylphenyl)ethyl]-1-propan-2-ylpyrazol-4-amine
CID 62904585
5-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 56910693
N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]cyclopropanamine
CID 90326100
N-[2-methyl-4-[[(1R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]amino]phenyl]acetamide
CID 34284461
N-[2-methyl-4-[[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]amino]phenyl]acetamide
CID 34284466
4-chloro-N-[4-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethylamino]phenyl]benzamide
CID 47485656

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine?
The IUPAC name of 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine (CID 75507091) is 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine.
What is the SMILES notation for 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine?
The canonical SMILES for 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine is CC(C)c1noc(C(C)Nc2cnn(C(C)C)c2)n1.
What is the InChIKey of 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine?
The InChIKey is KDOKLUVZRWQKFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-8(2)12-16-13(19-17-12)10(5)15-11-6-14-18(7-11)9(3)4/h6-10,15H,1-5H3.
What are the key properties of 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine?
1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine has a molecular weight of 263.34 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-N-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazol-4-amine is sourced from PubChem (CID 75507091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).