N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide

C10H23N3O — CID 62641683

IUPACN-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide
SMILESCCN(C)CCNC(=O)CCCNC
InChIInChI=1S/C10H23N3O/c1-4-13(3)9-8-12-10(14)6-5-7-11-2/h11H,4-9H2,1-3H3,(H,12,14)
InChIKeyIFFCYHMENBKOQX-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.05
Rot. Bonds8

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

N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide (PubChem CID 62641683) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide.

Molecular Properties

Compound NameN-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide
PubChem CID62641683
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC NameN-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide
SMILESCCN(C)CCNC(=O)CCCNC
InChIInChI=1S/C10H23N3O/c1-4-13(3)9-8-12-10(14)6-5-7-11-2/h11H,4-9H2,1-3H3,(H,12,14)
InChIKeyIFFCYHMENBKOQX-UHFFFAOYSA-N
XLogP0.05
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(dimethylamino)ethyl]-4-(methylamino)butanamide
CID 60841312
7-amino-N-[2-[ethyl(methyl)amino]ethyl]heptanamide;dihydrochloride
CID 119866060
N-[2-[(4-fluorophenyl)methyl-methylamino]ethyl]-4-(methylamino)butanamide
CID 119896354
N-[2-[cyclopropyl(ethyl)amino]ethyl]-4-(methylamino)butanamide;dihydrochloride
CID 119874340
3-(cyclopropylamino)-N-[2-[ethyl(methyl)amino]ethyl]propanamide
CID 62640423
N-[2-[ethyl(methyl)amino]ethyl]-3-methylbutanamide
CID 146890842
ethane;N'-ethyl-N,N'-dimethylethane-1,2-diamine;methanol
CID 144534922
3-[3-aminopropyl(methyl)amino]-N-[3-(methylamino)propyl]propanamide
CID 102040289
ethane;N'-ethyl-N,N'-dimethylethane-1,2-diamine
CID 142870975
N-[3-(methylamino)propyl]butanamide
CID 43600791
ethane;N-[2-[ethyl(methyl)amino]ethyl]acetamide
CID 142011990
N-[2-(ethylamino)-2-oxoethyl]-4-(methylamino)butanamide
CID 60843110

Frequently Asked Questions

What is the IUPAC name of N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide?
The IUPAC name of N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide (CID 62641683) is N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide.
What is the SMILES notation for N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide?
The canonical SMILES for N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide is CCN(C)CCNC(=O)CCCNC.
What is the InChIKey of N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide?
The InChIKey is IFFCYHMENBKOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O/c1-4-13(3)9-8-12-10(14)6-5-7-11-2/h11H,4-9H2,1-3H3,(H,12,14).
What are the key properties of N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide?
N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide has a molecular weight of 201.31 g/mol, XLogP of 0.05, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide is sourced from PubChem (CID 62641683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).