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

C15H30N2O — CID 60980793

IUPACN-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide
SMILESCCCC1CCC(NCC(=O)NC(C)(C)C)CC1
InChIInChI=1S/C15H30N2O/c1-5-6-12-7-9-13(10-8-12)16-11-14(18)17-15(2,3)4/h12-13,16H,5-11H2,1-4H3,(H,17,18)
InChIKeyUJLCYIUIVRDZQJ-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.85
Rot. Bonds5

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

N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide (PubChem CID 60980793) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide
PubChem CID60980793
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide
SMILESCCCC1CCC(NCC(=O)NC(C)(C)C)CC1
InChIInChI=1S/C15H30N2O/c1-5-6-12-7-9-13(10-8-12)16-11-14(18)17-15(2,3)4/h12-13,16H,5-11H2,1-4H3,(H,17,18)
InChIKeyUJLCYIUIVRDZQJ-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide?
The IUPAC name of N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide (CID 60980793) is N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide?
The canonical SMILES for N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide is CCCC1CCC(NCC(=O)NC(C)(C)C)CC1.
What is the InChIKey of N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide?
The InChIKey is UJLCYIUIVRDZQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-5-6-12-7-9-13(10-8-12)16-11-14(18)17-15(2,3)4/h12-13,16H,5-11H2,1-4H3,(H,17,18).
What are the key properties of N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide?
N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide has a molecular weight of 254.42 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(4-propylcyclohexyl)amino]acetamide is sourced from PubChem (CID 60980793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).