N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide

C12H24N2O2 — CID 106916626

IUPACN,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide
SMILESCCC(C)C(=O)CN(C)CC(C)C(=O)NC
InChIInChI=1S/C12H24N2O2/c1-6-9(2)11(15)8-14(5)7-10(3)12(16)13-4/h9-10H,6-8H2,1-5H3,(H,13,16)
InChIKeyHMDZDCMWABDPDP-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.92
Rot. Bonds7

About N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide

N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide (PubChem CID 106916626) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide.

Molecular Properties

Compound NameN,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide
PubChem CID106916626
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide
SMILESCCC(C)C(=O)CN(C)CC(C)C(=O)NC
InChIInChI=1S/C12H24N2O2/c1-6-9(2)11(15)8-14(5)7-10(3)12(16)13-4/h9-10H,6-8H2,1-5H3,(H,13,16)
InChIKeyHMDZDCMWABDPDP-UHFFFAOYSA-N
XLogP0.92
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide?
The IUPAC name of N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide (CID 106916626) is N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide.
What is the SMILES notation for N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide?
The canonical SMILES for N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide is CCC(C)C(=O)CN(C)CC(C)C(=O)NC.
What is the InChIKey of N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide?
The InChIKey is HMDZDCMWABDPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-6-9(2)11(15)8-14(5)7-10(3)12(16)13-4/h9-10H,6-8H2,1-5H3,(H,13,16).
What are the key properties of N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide?
N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide has a molecular weight of 228.34 g/mol, XLogP of 0.92, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide is sourced from PubChem (CID 106916626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).