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

C15H25N3O2 — CID 53195185

IUPACN-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide
SMILESCc1nc(C(=O)NCCN(C)C2CCCCC2)c(C)o1
InChIInChI=1S/C15H25N3O2/c1-11-14(17-12(2)20-11)15(19)16-9-10-18(3)13-7-5-4-6-8-13/h13H,4-10H2,1-3H3,(H,16,19)
InChIKeyQDPZBNKYQVHBML-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.29
Rot. Bonds5

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

N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide (PubChem CID 53195185) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide
PubChem CID53195185
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide
SMILESCc1nc(C(=O)NCCN(C)C2CCCCC2)c(C)o1
InChIInChI=1S/C15H25N3O2/c1-11-14(17-12(2)20-11)15(19)16-9-10-18(3)13-7-5-4-6-8-13/h13H,4-10H2,1-3H3,(H,16,19)
InChIKeyQDPZBNKYQVHBML-UHFFFAOYSA-N
XLogP2.29
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[cyclohexyl(methyl)amino]ethyl]-3-methylbenzamide
CID 121420012
N-[2-[cycloheptyl(methyl)amino]ethyl]-2-methylpropanamide
CID 59205256
N-[2-[cyclohexyl(methyl)amino]ethyl]thiophene-2-carboxamide
CID 86848703
3-(4-chlorophenyl)-N-[2-[cyclopentyl(methyl)amino]ethyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 46975659
2-bromo-N-[2-[cyclopentyl(methyl)amino]ethyl]benzamide
CID 63316134
N-[2-[cyclopentyl(methyl)amino]ethyl]-3,4-dihydroxybenzamide
CID 103956034
N-[2-[cyclopentyl(methyl)amino]ethyl]-3-hydroxypyridine-4-carboxamide
CID 80707249
2-chloro-N-[2-[cyclopentyl(methyl)amino]ethyl]-6-(methylamino)pyridine-4-carboxamide
CID 63317161
N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide
CID 63316486
3-[2-[cyclopentyl(methyl)amino]ethyl]-1-ethyl-1-methylurea
CID 115613946
N-[2-[cyclopentyl(methyl)amino]ethyl]-5-(ethylamino)-1,3,4-thiadiazole-2-carboxamide
CID 80616910
2-[2-[cyclopropyl(methyl)amino]ethylcarbamoyl]-3,6-dimethylbenzoic acid
CID 103429053

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide (CID 53195185) is N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide is Cc1nc(C(=O)NCCN(C)C2CCCCC2)c(C)o1.
What is the InChIKey of N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide?
The InChIKey is QDPZBNKYQVHBML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-11-14(17-12(2)20-11)15(19)16-9-10-18(3)13-7-5-4-6-8-13/h13H,4-10H2,1-3H3,(H,16,19).
What are the key properties of N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide?
N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclohexyl(methyl)amino]ethyl]-2,5-dimethyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 53195185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).