(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide

C15H33N3O — CID 102993062

IUPAC(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide
SMILESCCN(CC)CCCN(CC)C(=O)[C@@H](N)CC(C)C
InChIInChI=1S/C15H33N3O/c1-6-17(7-2)10-9-11-18(8-3)15(19)14(16)12-13(4)5/h13-14H,6-12,16H2,1-5H3/t14-/m0/s1
InChIKeyDKGMJJIGEDNZTH-AWEZNQCLSA-N
MW271.45 g/mol
LogP1.94
Rot. Bonds10

About (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide

(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide (PubChem CID 102993062) has the molecular formula C15H33N3O and a molecular weight of 271.45 g/mol. Its IUPAC name is (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide
PubChem CID102993062
Molecular FormulaC15H33N3O
Molecular Weight271.45 g/mol
Exact Mass271.26
IUPAC Name(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide
SMILESCCN(CC)CCCN(CC)C(=O)[C@@H](N)CC(C)C
InChIInChI=1S/C15H33N3O/c1-6-17(7-2)10-9-11-18(8-3)15(19)14(16)12-13(4)5/h13-14H,6-12,16H2,1-5H3/t14-/m0/s1
InChIKeyDKGMJJIGEDNZTH-AWEZNQCLSA-N
XLogP1.94
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 ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-amino-N-[3-(dimethylamino)propyl]-N-ethyl-4-methylpentanamide
CID 102992753
2-amino-N,N-diethyl-4-methylpentanamide
CID 24697294
(2S)-2-amino-4-methyl-N,N-dipentylpentanamide
CID 61164908
(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-3-methylpentanamide
CID 102993086
(2R)-2-amino-N,N-dihexyl-4-methylpentanamide
CID 104903090
2-amino-N-ethyl-4-methyl-N-prop-2-enylpentanamide
CID 81489014
(2R)-2-amino-N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)pentanamide
CID 104903332
(2S)-2-amino-N-heptyl-N-(3-hydroxypropyl)-4-methylpentanamide
CID 61164222
(2S)-2-amino-N-[3-(dimethylamino)propyl]-N-ethylbutanamide
CID 102992755
2-amino-N-(cyclopropylmethyl)-N-ethyl-4-methylpentanamide
CID 63954154
(2S)-2-amino-N-[3-(dimethylamino)propyl]-N-ethylpropanamide
CID 102992823
2-amino-N-[3-(dimethylamino)propyl]-N-ethylpropanamide
CID 102992838

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide?
The IUPAC name of (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide (CID 102993062) is (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide.
What is the SMILES notation for (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide?
The canonical SMILES for (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide is CCN(CC)CCCN(CC)C(=O)[C@@H](N)CC(C)C.
What is the InChIKey of (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide?
The InChIKey is DKGMJJIGEDNZTH-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H33N3O/c1-6-17(7-2)10-9-11-18(8-3)15(19)14(16)12-13(4)5/h13-14H,6-12,16H2,1-5H3/t14-/m0/s1.
What are the key properties of (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide?
(2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide has a molecular weight of 271.45 g/mol, XLogP of 1.94, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[3-(diethylamino)propyl]-N-ethyl-4-methylpentanamide is sourced from PubChem (CID 102993062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).