N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide

C15H25N3O2 — CID 74234028

IUPACN-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)N(CCN(C)C)C1CCCCC1
InChIInChI=1S/C15H25N3O2/c1-12-14(16-11-20-12)15(19)18(10-9-17(2)3)13-7-5-4-6-8-13/h11,13H,4-10H2,1-3H3
InChIKeyCBNHNUVPMLHASC-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.32
Rot. Bonds5

About N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide

N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide (PubChem CID 74234028) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide
PubChem CID74234028
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)N(CCN(C)C)C1CCCCC1
InChIInChI=1S/C15H25N3O2/c1-12-14(16-11-20-12)15(19)18(10-9-17(2)3)13-7-5-4-6-8-13/h11,13H,4-10H2,1-3H3
InChIKeyCBNHNUVPMLHASC-UHFFFAOYSA-N
XLogP2.32
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide (CID 74234028) is N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide is Cc1ocnc1C(=O)N(CCN(C)C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide?
The InChIKey is CBNHNUVPMLHASC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-12-14(16-11-20-12)15(19)18(10-9-17(2)3)13-7-5-4-6-8-13/h11,13H,4-10H2,1-3H3.
What are the key properties of N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide?
N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 2.32, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 74234028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).