N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide

C17H35N3O2 — CID 119655273

IUPACN-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide
SMILESCCC(CC)C(C(=O)N(C)CC(C)(C)CN)N1CCOCC1
InChIInChI=1S/C17H35N3O2/c1-6-14(7-2)15(20-8-10-22-11-9-20)16(21)19(5)13-17(3,4)12-18/h14-15H,6-13,18H2,1-5H3
InChIKeyBTOBHEZPHURCBK-UHFFFAOYSA-N
MW313.49 g/mol
LogP1.57
Rot. Bonds8

About N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide

N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide (PubChem CID 119655273) has the molecular formula C17H35N3O2 and a molecular weight of 313.49 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide
PubChem CID119655273
Molecular FormulaC17H35N3O2
Molecular Weight313.49 g/mol
Exact Mass313.27
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide
SMILESCCC(CC)C(C(=O)N(C)CC(C)(C)CN)N1CCOCC1
InChIInChI=1S/C17H35N3O2/c1-6-14(7-2)15(20-8-10-22-11-9-20)16(21)19(5)13-17(3,4)12-18/h14-15H,6-13,18H2,1-5H3
InChIKeyBTOBHEZPHURCBK-UHFFFAOYSA-N
XLogP1.57
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.49
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-2-morpholin-4-ylpentanamide
CID 154739613
N-(2-amino-2-ethylbutyl)-3-ethyl-2-morpholin-4-ylpentanamide
CID 119642279
(2R)-2-amino-N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylpropanamide;hydrochloride
CID 120873433
N-(3-amino-2,2-dimethylpropyl)-N-methylpyrrolidine-1-carboxamide
CID 79652128
2-[(3-amino-2,2-dimethylpropyl)-propylamino]-1-morpholin-4-ylpropan-1-one
CID 79661173
(3S)-1-[(2R)-3-ethyl-2-morpholin-4-ylpentanoyl]pyrrolidine-3-carboxylic acid
CID 124610614
3-ethyl-N-[(2R)-2-(ethylamino)propyl]-2-morpholin-4-ylpentanamide;dihydrochloride
CID 120652628
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-morpholin-4-ylpyridine-3-carboxamide;dihydrochloride
CID 119654497
3-ethyl-N-[3-(methylamino)propyl]-2-morpholin-4-ylpentanamide;dihydrochloride
CID 119432428
N-(3-amino-2,2-dimethylpropyl)-4-ethyl-N-methyl-3-morpholin-4-ylsulfonylbenzamide;hydrochloride
CID 119653213
3-methyl-2-morpholin-4-ylpentanoic acid
CID 61319548
methyl (2S,3S)-2,3-dimorpholin-4-ylpentanoate
CID 101419276

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide (CID 119655273) is N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide is CCC(CC)C(C(=O)N(C)CC(C)(C)CN)N1CCOCC1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide?
The InChIKey is BTOBHEZPHURCBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3O2/c1-6-14(7-2)15(20-8-10-22-11-9-20)16(21)19(5)13-17(3,4)12-18/h14-15H,6-13,18H2,1-5H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide?
N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide has a molecular weight of 313.49 g/mol, XLogP of 1.57, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-3-ethyl-N-methyl-2-morpholin-4-ylpentanamide is sourced from PubChem (CID 119655273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).