2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide

C15H33N3O — CID 102993073

IUPAC2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide
SMILESCCN(CC)CCCN(CC)C(=O)C(N)(CC)CC
InChIInChI=1S/C15H33N3O/c1-6-15(16,7-2)14(19)18(10-5)13-11-12-17(8-3)9-4/h6-13,16H2,1-5H3
InChIKeyUPJYQLLSYHQOJY-UHFFFAOYSA-N
MW271.45 g/mol
LogP2.08
Rot. Bonds10

About 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide

2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide (PubChem CID 102993073) has the molecular formula C15H33N3O and a molecular weight of 271.45 g/mol. Its IUPAC name is 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide.

Molecular Properties

Compound Name2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide
PubChem CID102993073
Molecular FormulaC15H33N3O
Molecular Weight271.45 g/mol
Exact Mass271.26
IUPAC Name2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide
SMILESCCN(CC)CCCN(CC)C(=O)C(N)(CC)CC
InChIInChI=1S/C15H33N3O/c1-6-15(16,7-2)14(19)18(10-5)13-11-12-17(8-3)9-4/h6-13,16H2,1-5H3
InChIKeyUPJYQLLSYHQOJY-UHFFFAOYSA-N
XLogP2.08
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-carbamothioyl-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide
CID 102993358
2-amino-5-[3-(diethylamino)propyl-ethylamino]-2-ethylpentanoic acid
CID 106806545
N-[3-(diethylamino)propyl]-N-ethylacetamide
CID 102998319
tert-butyl N-[3-(diethylamino)propyl]-N-ethylcarbamate
CID 102998322
N-[3-(diethylamino)propyl]-N-ethylprop-2-enamide
CID 102991803
7-amino-N-[3-(diethylamino)propyl]-N-ethylheptanamide
CID 102993033
2-amino-2-ethyl-N,N-dimethylbutanamide;hydrochloride
CID 86674742
(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-3-methylpentanamide
CID 102993086
(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide
CID 102993062
2-[3-(diethylamino)propyl-ethylamino]acetamide
CID 102996272
3-butyl-1-[3-(diethylamino)propyl]-1-ethylurea
CID 102992273
3-[bis[3-(diethylamino)propyl]amino]propanamide
CID 87989478

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide?
The IUPAC name of 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide (CID 102993073) is 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide.
What is the SMILES notation for 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide?
The canonical SMILES for 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide is CCN(CC)CCCN(CC)C(=O)C(N)(CC)CC.
What is the InChIKey of 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide?
The InChIKey is UPJYQLLSYHQOJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3O/c1-6-15(16,7-2)14(19)18(10-5)13-11-12-17(8-3)9-4/h6-13,16H2,1-5H3.
What are the key properties of 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide?
2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide has a molecular weight of 271.45 g/mol, XLogP of 2.08, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(diethylamino)propyl]-N,2-diethylbutanamide is sourced from PubChem (CID 102993073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).