4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide

C15H34N4O — CID 102992088

IUPAC4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide
SMILESCCNC(=O)CC(CN)N(CC)CCCN(CC)CC
InChIInChI=1S/C15H34N4O/c1-5-17-15(20)12-14(13-16)19(8-4)11-9-10-18(6-2)7-3/h14H,5-13,16H2,1-4H3,(H,17,20)
InChIKeyNZBQGSFDIKRFIJ-UHFFFAOYSA-N
MW286.46 g/mol
LogP0.89
Rot. Bonds12

About 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide

4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide (PubChem CID 102992088) has the molecular formula C15H34N4O and a molecular weight of 286.46 g/mol. Its IUPAC name is 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide.

Molecular Properties

Compound Name4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide
PubChem CID102992088
Molecular FormulaC15H34N4O
Molecular Weight286.46 g/mol
Exact Mass286.27
IUPAC Name4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide
SMILESCCNC(=O)CC(CN)N(CC)CCCN(CC)CC
InChIInChI=1S/C15H34N4O/c1-5-17-15(20)12-14(13-16)19(8-4)11-9-10-18(6-2)7-3/h14H,5-13,16H2,1-4H3,(H,17,20)
InChIKeyNZBQGSFDIKRFIJ-UHFFFAOYSA-N
XLogP0.89
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-3-[cyclobutylmethyl(ethyl)amino]-N-ethylbutanamide
CID 107397676
4-amino-3-[butan-2-yl(ethyl)amino]-N-ethylbutanamide
CID 66428428
3-(aminomethyl)-N-[3-(diethylamino)propyl]pentanamide
CID 81070117
4-amino-3-[ethyl(2-methoxyethyl)amino]-N-methylbutanamide
CID 66427989
4-amino-3-[2-methoxyethyl(3-methoxypropyl)amino]-N-propylbutanamide
CID 66428252
4-amino-N-ethyl-3-[methyl(1-methylsulfanylpropan-2-yl)amino]butanamide
CID 112658549
2-N-[3-(diethylamino)propyl]-2-N-ethyl-3-phenylpropane-1,2-diamine
CID 102992091
2-[3-(diethylamino)propyl-ethylamino]butanehydrazide
CID 102998207
3-amino-2-[butyl(ethyl)amino]propan-1-ol
CID 104710797
4-amino-3-[butyl(ethyl)amino]-1-piperidin-1-ylbutan-1-one
CID 66430497
2-[3-aminopropyl(ethyl)amino]-N-(ethylcarbamoyl)propanamide
CID 43137250
4-amino-3-[cyclopropylmethyl(ethyl)amino]-N-methylbutanamide
CID 66427576

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide?
The IUPAC name of 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide (CID 102992088) is 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide.
What is the SMILES notation for 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide?
The canonical SMILES for 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide is CCNC(=O)CC(CN)N(CC)CCCN(CC)CC.
What is the InChIKey of 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide?
The InChIKey is NZBQGSFDIKRFIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N4O/c1-5-17-15(20)12-14(13-16)19(8-4)11-9-10-18(6-2)7-3/h14H,5-13,16H2,1-4H3,(H,17,20).
What are the key properties of 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide?
4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide has a molecular weight of 286.46 g/mol, XLogP of 0.89, 12 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-[3-(diethylamino)propyl-ethylamino]-N-ethylbutanamide is sourced from PubChem (CID 102992088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).