3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide

C14H31N3O — CID 62669456

IUPAC3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide
SMILESCCN(CC)CCN(CC(C)C)C(=O)C(C)CN
InChIInChI=1S/C14H31N3O/c1-6-16(7-2)8-9-17(11-12(3)4)14(18)13(5)10-15/h12-13H,6-11,15H2,1-5H3
InChIKeyMDKCXNVOQHCLJJ-UHFFFAOYSA-N
MW257.42 g/mol
LogP1.41
Rot. Bonds9

About 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide

3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide (PubChem CID 62669456) has the molecular formula C14H31N3O and a molecular weight of 257.42 g/mol. Its IUPAC name is 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide
PubChem CID62669456
Molecular FormulaC14H31N3O
Molecular Weight257.42 g/mol
Exact Mass257.25
IUPAC Name3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide
SMILESCCN(CC)CCN(CC(C)C)C(=O)C(C)CN
InChIInChI=1S/C14H31N3O/c1-6-16(7-2)8-9-17(11-12(3)4)14(18)13(5)10-15/h12-13H,6-11,15H2,1-5H3
InChIKeyMDKCXNVOQHCLJJ-UHFFFAOYSA-N
XLogP1.41
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide?
The IUPAC name of 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide (CID 62669456) is 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide?
The canonical SMILES for 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide is CCN(CC)CCN(CC(C)C)C(=O)C(C)CN.
What is the InChIKey of 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide?
The InChIKey is MDKCXNVOQHCLJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3O/c1-6-16(7-2)8-9-17(11-12(3)4)14(18)13(5)10-15/h12-13H,6-11,15H2,1-5H3.
What are the key properties of 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide?
3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide has a molecular weight of 257.42 g/mol, XLogP of 1.41, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(diethylamino)ethyl]-2-methyl-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 62669456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).