3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide

C9H20N2O — CID 18678958

IUPAC3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)CN(C)C
InChIInChI=1S/C9H20N2O/c1-7(2)10-9(12)8(3)6-11(4)5/h7-8H,6H2,1-5H3,(H,10,12)
InChIKeySUPKKDKJNROEPK-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.71
Rot. Bonds4

About 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide

3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide (PubChem CID 18678958) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide
PubChem CID18678958
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)CN(C)C
InChIInChI=1S/C9H20N2O/c1-7(2)10-9(12)8(3)6-11(4)5/h7-8H,6H2,1-5H3,(H,10,12)
InChIKeySUPKKDKJNROEPK-UHFFFAOYSA-N
XLogP0.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide?
The IUPAC name of 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide (CID 18678958) is 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide is CC(C)NC(=O)C(C)CN(C)C.
What is the InChIKey of 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide?
The InChIKey is SUPKKDKJNROEPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-7(2)10-9(12)8(3)6-11(4)5/h7-8H,6H2,1-5H3,(H,10,12).
What are the key properties of 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide?
3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide has a molecular weight of 172.27 g/mol, XLogP of 0.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 18678958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).