N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide

C14H28N2O — CID 63994710

IUPACN-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide
SMILESCC1CCC(NCC(=O)NC(C)(C)C)C(C)C1
InChIInChI=1S/C14H28N2O/c1-10-6-7-12(11(2)8-10)15-9-13(17)16-14(3,4)5/h10-12,15H,6-9H2,1-5H3,(H,16,17)
InChIKeyMQPBFEKJPMKPQY-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.32
Rot. Bonds3

About N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide

N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide (PubChem CID 63994710) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide
PubChem CID63994710
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide
SMILESCC1CCC(NCC(=O)NC(C)(C)C)C(C)C1
InChIInChI=1S/C14H28N2O/c1-10-6-7-12(11(2)8-10)15-9-13(17)16-14(3,4)5/h10-12,15H,6-9H2,1-5H3,(H,16,17)
InChIKeyMQPBFEKJPMKPQY-UHFFFAOYSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-[(2-methylcyclohexyl)amino]acetamide
CID 43179946
N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]propanamide
CID 63995714
N-(2-cyanoethyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide
CID 63995878
3-[(2,4-dimethylcyclohexyl)amino]-2-hydroxy-2-methylpropanoic acid
CID 104644528
N-(4-chlorophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide
CID 63995689
N-(2-bromophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide
CID 63994904
N-(1,3-dioxolan-2-ylmethyl)-2,4-dimethylcyclohexan-1-amine
CID 131175670
N-(2,2-dimethylbutyl)-2,4-dimethylcyclohexan-1-amine
CID 103460870
2-[(3-aminocyclopentyl)amino]-N-tert-butylacetamide
CID 115356260
N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide
CID 60980793
2,4-dimethyl-N-(2,3,3-trimethylbutyl)cyclohexan-1-amine
CID 83143221
N-tert-butyl-3-[(2-methylcyclohexyl)amino]propanamide
CID 112688523

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide?
The IUPAC name of N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide (CID 63994710) is N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide?
The canonical SMILES for N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide is CC1CCC(NCC(=O)NC(C)(C)C)C(C)C1.
What is the InChIKey of N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide?
The InChIKey is MQPBFEKJPMKPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-10-6-7-12(11(2)8-10)15-9-13(17)16-14(3,4)5/h10-12,15H,6-9H2,1-5H3,(H,16,17).
What are the key properties of N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide?
N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide has a molecular weight of 240.39 g/mol, XLogP of 2.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(2,4-dimethylcyclohexyl)amino]acetamide is sourced from PubChem (CID 63994710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).