N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide

C15H26N4O3 — CID 71982835

IUPACN-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide
SMILESCc1noc(C)c1NC(=O)N1CCN(CCOC(C)C)CC1
InChIInChI=1S/C15H26N4O3/c1-11(2)21-10-9-18-5-7-19(8-6-18)15(20)16-14-12(3)17-22-13(14)4/h11H,5-10H2,1-4H3,(H,16,20)
InChIKeyAHQYKYWBHULGJG-UHFFFAOYSA-N
MW310.40 g/mol
LogP1.87
Rot. Bonds5

About N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide

N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide (PubChem CID 71982835) has the molecular formula C15H26N4O3 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide
PubChem CID71982835
Molecular FormulaC15H26N4O3
Molecular Weight310.40 g/mol
Exact Mass310.20
IUPAC NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide
SMILESCc1noc(C)c1NC(=O)N1CCN(CCOC(C)C)CC1
InChIInChI=1S/C15H26N4O3/c1-11(2)21-10-9-18-5-7-19(8-6-18)15(20)16-14-12(3)17-22-13(14)4/h11H,5-10H2,1-4H3,(H,16,20)
InChIKeyAHQYKYWBHULGJG-UHFFFAOYSA-N
XLogP1.87
TPSA70.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,6-dimethylphenyl)-4-(2-methoxyethyl)piperazine-1-carboxamide
CID 113104947
4-(2-methoxyethyl)-N-(2-methyl-6-propan-2-ylphenyl)piperazine-1-carboxamide
CID 113104956
2-morpholin-4-yl-1-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]ethanone
CID 55506472
N-[2,6-di(propan-2-yl)phenyl]-4-(2-methoxyethyl)piperazine-1-carboxamide
CID 113105012
1-[4-(7-propan-2-yloxyheptyl)piperazin-1-yl]ethanone
CID 171735482
N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-[(4-fluorophenyl)methyl]-3-propan-2-yl-1,4-diazepane-1-carboxamide
CID 56872699
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-(4-fluorophenyl)piperazine-1-carboxamide
CID 47022600
(E)-3-(5-methylfuran-2-yl)-1-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]prop-2-en-1-one
CID 75534043
N-(2-methyl-6-propan-2-ylphenyl)-4-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113105948
(2S)-N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-hydroxypropanamide
CID 130616947
3-amino-1-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]butan-1-one;dihydrochloride
CID 119891709
2-amino-2-(oxan-4-yl)-1-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]ethanone
CID 120800962

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide?
The IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide (CID 71982835) is N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide.
What is the SMILES notation for N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide?
The canonical SMILES for N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide is Cc1noc(C)c1NC(=O)N1CCN(CCOC(C)C)CC1.
What is the InChIKey of N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide?
The InChIKey is AHQYKYWBHULGJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O3/c1-11(2)21-10-9-18-5-7-19(8-6-18)15(20)16-14-12(3)17-22-13(14)4/h11H,5-10H2,1-4H3,(H,16,20).
What are the key properties of N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide?
N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 1.87, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-propan-2-yloxyethyl)piperazine-1-carboxamide is sourced from PubChem (CID 71982835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).