2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide

C9H21N3O2 — CID 63054468

IUPAC2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide
SMILESCCN(CCOC)CCC(N)C(N)=O
InChIInChI=1S/C9H21N3O2/c1-3-12(6-7-14-2)5-4-8(10)9(11)13/h8H,3-7,10H2,1-2H3,(H2,11,13)
InChIKeyLDENIHIYQDALAJ-UHFFFAOYSA-N
MW203.29 g/mol
LogP-0.84
Rot. Bonds8

About 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide

2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide (PubChem CID 63054468) has the molecular formula C9H21N3O2 and a molecular weight of 203.29 g/mol. Its IUPAC name is 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide.

Molecular Properties

Compound Name2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide
PubChem CID63054468
Molecular FormulaC9H21N3O2
Molecular Weight203.29 g/mol
Exact Mass203.16
IUPAC Name2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide
SMILESCCN(CCOC)CCC(N)C(N)=O
InChIInChI=1S/C9H21N3O2/c1-3-12(6-7-14-2)5-4-8(10)9(11)13/h8H,3-7,10H2,1-2H3,(H2,11,13)
InChIKeyLDENIHIYQDALAJ-UHFFFAOYSA-N
XLogP-0.84
TPSA81.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-4-[bis(2-methoxyethyl)amino]butanamide
CID 63053778
2-amino-4-[2-methoxyethyl(3-methoxypropyl)amino]butanamide
CID 63055708
methyl 4-[ethyl(2-methoxyethyl)amino]-2-(methylamino)butanoate
CID 63055174
2-[ethyl(2-methoxyethyl)amino]ethyl 2-methylpropanoate
CID 89149379
ethyl 2-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butanoate
CID 63053393
2-amino-4-(dibutylamino)butanamide
CID 63027628
2-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butanoic acid
CID 63055687
3-[ethyl(2-methoxyethyl)amino]propylurea
CID 89337581
(3R)-3-amino-5-(diethylamino)pentan-2-one
CID 88995223
(2R)-2-amino-3-(diethylamino)propanamide
CID 94048632
(2S)-1-N-ethyl-1-N-(2-methoxyethyl)propane-1,2-diamine
CID 103934538
ethane;N-ethyl-N-(2-methoxyethyl)propan-1-amine
CID 143133671

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide?
The IUPAC name of 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide (CID 63054468) is 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide.
What is the SMILES notation for 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide?
The canonical SMILES for 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide is CCN(CCOC)CCC(N)C(N)=O.
What is the InChIKey of 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide?
The InChIKey is LDENIHIYQDALAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2/c1-3-12(6-7-14-2)5-4-8(10)9(11)13/h8H,3-7,10H2,1-2H3,(H2,11,13).
What are the key properties of 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide?
2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide has a molecular weight of 203.29 g/mol, XLogP of -0.84, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide is sourced from PubChem (CID 63054468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).