N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide

C14H28N2O — CID 114174284

IUPACN-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide
SMILESCCC(C)(CC)NC(=O)CC1NCCCC1C
InChIInChI=1S/C14H28N2O/c1-5-14(4,6-2)16-13(17)10-12-11(3)8-7-9-15-12/h11-12,15H,5-10H2,1-4H3,(H,16,17)
InChIKeyDCBQDZCRDJNIGB-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.46
Rot. Bonds5

About N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide

N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide (PubChem CID 114174284) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide.

Molecular Properties

Compound NameN-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide
PubChem CID114174284
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide
SMILESCCC(C)(CC)NC(=O)CC1NCCCC1C
InChIInChI=1S/C14H28N2O/c1-5-14(4,6-2)16-13(17)10-12-11(3)8-7-9-15-12/h11-12,15H,5-10H2,1-4H3,(H,16,17)
InChIKeyDCBQDZCRDJNIGB-UHFFFAOYSA-N
XLogP2.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide?
The IUPAC name of N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide (CID 114174284) is N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide.
What is the SMILES notation for N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide?
The canonical SMILES for N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide is CCC(C)(CC)NC(=O)CC1NCCCC1C.
What is the InChIKey of N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide?
The InChIKey is DCBQDZCRDJNIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-14(4,6-2)16-13(17)10-12-11(3)8-7-9-15-12/h11-12,15H,5-10H2,1-4H3,(H,16,17).
What are the key properties of N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide?
N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide has a molecular weight of 240.39 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide is sourced from PubChem (CID 114174284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).