2-(ethylamino)-4-[ethyl(methyl)amino]butanamide

C9H21N3O — CID 63029588

IUPAC2-(ethylamino)-4-[ethyl(methyl)amino]butanamide
SMILESCCNC(CCN(C)CC)C(N)=O
InChIInChI=1S/C9H21N3O/c1-4-11-8(9(10)13)6-7-12(3)5-2/h8,11H,4-7H2,1-3H3,(H2,10,13)
InChIKeyJAQHYHKYXYHPBB-UHFFFAOYSA-N
MW187.29 g/mol
LogP-0.21
Rot. Bonds7

About 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide

2-(ethylamino)-4-[ethyl(methyl)amino]butanamide (PubChem CID 63029588) has the molecular formula C9H21N3O and a molecular weight of 187.29 g/mol. Its IUPAC name is 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide.

Molecular Properties

Compound Name2-(ethylamino)-4-[ethyl(methyl)amino]butanamide
PubChem CID63029588
Molecular FormulaC9H21N3O
Molecular Weight187.29 g/mol
Exact Mass187.17
IUPAC Name2-(ethylamino)-4-[ethyl(methyl)amino]butanamide
SMILESCCNC(CCN(C)CC)C(N)=O
InChIInChI=1S/C9H21N3O/c1-4-11-8(9(10)13)6-7-12(3)5-2/h8,11H,4-7H2,1-3H3,(H2,10,13)
InChIKeyJAQHYHKYXYHPBB-UHFFFAOYSA-N
XLogP-0.21
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[butyl(methyl)amino]-2-(ethylamino)butanamide
CID 63029682
4-[2,2-dimethylpropyl(methyl)amino]-2-(ethylamino)butanamide
CID 63055540
2-(ethylamino)-4-[methyl(pentan-3-yl)amino]butanamide
CID 63030006
4-[butan-2-yl(ethyl)amino]-2-(ethylamino)butanamide
CID 63027471
4-[cyclopropyl(methyl)amino]-2-(ethylamino)butanamide
CID 63027258
2-(ethylamino)-4-[1-methoxypropan-2-yl(methyl)amino]butanamide
CID 63055682
2-(ethylamino)-4-[ethyl(2-methylbutyl)amino]butanamide
CID 79481579
4-[cyclopentyl(methyl)amino]-2-(ethylamino)butanamide
CID 63028816
2-(ethylamino)-4-[2-methylpropyl(propan-2-yl)amino]butanamide
CID 55143166
2-(ethylamino)-4-[methyl-(4-methylcyclohexyl)amino]butanamide
CID 63054490
ethyl 4-[ethyl(methyl)amino]-2-(propylamino)butanoate
CID 63028998
(2S)-6-amino-2-(ethylamino)hexanamide
CID 90248692

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide?
The IUPAC name of 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide (CID 63029588) is 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide.
What is the SMILES notation for 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide?
The canonical SMILES for 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide is CCNC(CCN(C)CC)C(N)=O.
What is the InChIKey of 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide?
The InChIKey is JAQHYHKYXYHPBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O/c1-4-11-8(9(10)13)6-7-12(3)5-2/h8,11H,4-7H2,1-3H3,(H2,10,13).
What are the key properties of 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide?
2-(ethylamino)-4-[ethyl(methyl)amino]butanamide has a molecular weight of 187.29 g/mol, XLogP of -0.21, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-[ethyl(methyl)amino]butanamide is sourced from PubChem (CID 63029588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).