4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide

C11H25N3O — CID 63028616

IUPAC4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide
SMILESCCN(CCC(NC)C(N)=O)CC(C)C
InChIInChI=1S/C11H25N3O/c1-5-14(8-9(2)3)7-6-10(13-4)11(12)15/h9-10,13H,5-8H2,1-4H3,(H2,12,15)
InChIKeySQTVMZWTDNUUII-UHFFFAOYSA-N
MW215.34 g/mol
LogP0.43
Rot. Bonds8

About 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide

4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide (PubChem CID 63028616) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide.

Molecular Properties

Compound Name4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide
PubChem CID63028616
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC Name4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide
SMILESCCN(CCC(NC)C(N)=O)CC(C)C
InChIInChI=1S/C11H25N3O/c1-5-14(8-9(2)3)7-6-10(13-4)11(12)15/h9-10,13H,5-8H2,1-4H3,(H2,12,15)
InChIKeySQTVMZWTDNUUII-UHFFFAOYSA-N
XLogP0.43
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-2-(methylamino)butanamide
CID 63053033
methyl 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanoate
CID 63029585
2-(cyclopropylamino)-4-[ethyl(2-methylpropyl)amino]butanamide
CID 55143527
4-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-2-(methylamino)butanoic acid
CID 55143158
4-[1-(dimethylamino)propan-2-yl-ethylamino]-2-(methylamino)butanamide
CID 103190946
2-(ethylamino)-4-[ethyl(2-methylbutyl)amino]butanamide
CID 79481579
2,5-bis(methylamino)hexanediamide
CID 66221520
4-(diethylamino)-2-(propylamino)butanamide
CID 63028178
4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide
CID 63029394
1-N-ethyl-3-N,4,4-trimethyl-1-N-(2-methylpropyl)pentane-1,3-diamine
CID 62623709
ethyl 4-[ethyl(propyl)amino]-2-(methylamino)butanoate
CID 63028830
4-[butan-2-yl(butyl)amino]-2-(methylamino)butanamide
CID 63053272

Frequently Asked Questions

What is the IUPAC name of 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide?
The IUPAC name of 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide (CID 63028616) is 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide.
What is the SMILES notation for 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide?
The canonical SMILES for 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide is CCN(CCC(NC)C(N)=O)CC(C)C.
What is the InChIKey of 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide?
The InChIKey is SQTVMZWTDNUUII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-5-14(8-9(2)3)7-6-10(13-4)11(12)15/h9-10,13H,5-8H2,1-4H3,(H2,12,15).
What are the key properties of 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide?
4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide has a molecular weight of 215.34 g/mol, XLogP of 0.43, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide is sourced from PubChem (CID 63028616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).