N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide

C21H32N2O2 — CID 25110499

IUPACN-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide
SMILESCC1CCCCC1N(C(=O)c1cc(C2CC2)on1)C1CCCCCC1
InChIInChI=1S/C21H32N2O2/c1-15-8-6-7-11-19(15)23(17-9-4-2-3-5-10-17)21(24)18-14-20(25-22-18)16-12-13-16/h14-17,19H,2-13H2,1H3
InChIKeySKMFQTAOSOOOIV-UHFFFAOYSA-N
MW344.50 g/mol
LogP5.30
Rot. Bonds4

About N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide

N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide (PubChem CID 25110499) has the molecular formula C21H32N2O2 and a molecular weight of 344.50 g/mol. Its IUPAC name is N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide
PubChem CID25110499
Molecular FormulaC21H32N2O2
Molecular Weight344.50 g/mol
Exact Mass344.25
IUPAC NameN-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide
SMILESCC1CCCCC1N(C(=O)c1cc(C2CC2)on1)C1CCCCCC1
InChIInChI=1S/C21H32N2O2/c1-15-8-6-7-11-19(15)23(17-9-4-2-3-5-10-17)21(24)18-14-20(25-22-18)16-12-13-16/h14-17,19H,2-13H2,1H3
InChIKeySKMFQTAOSOOOIV-UHFFFAOYSA-N
XLogP5.30
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.50
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Cym-5541
CID 17253208
N,N-dicyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5309153
N-cyclohexyl-N,5-dimethyl-3-isoxazolecarboxamide
CID 2814457
N-cyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5307570
N-cyclohexyl-5-cyclopropylisoxazole-3-carboxamide
CID 16188020
N-[1-(2-Chloroacetyl)-4-piperidinyl]-5-cyclopropyl-3-isoxazolecarboxamide
CID 118949515
N,N-dicyclohexyl-5-methylisoxazole-3-carboxamide
CID 3245758
N-(Butan-2-YL)-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 5307751
N,N-dicyclohexyl-5-isopropyl-3-isoxazolecarboxamide
CID 17253281
N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 25110485
5-cyclopropyl-N,N-bis(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide
CID 25110496
N-cyclohexyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide
CID 25110498

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide (CID 25110499) is N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide is CC1CCCCC1N(C(=O)c1cc(C2CC2)on1)C1CCCCCC1.
What is the InChIKey of N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide?
The InChIKey is SKMFQTAOSOOOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32N2O2/c1-15-8-6-7-11-19(15)23(17-9-4-2-3-5-10-17)21(24)18-14-20(25-22-18)16-12-13-16/h14-17,19H,2-13H2,1H3.
What are the key properties of N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide?
N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide has a molecular weight of 344.50 g/mol, XLogP of 5.30, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-5-cyclopropyl-N-(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 25110499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).