2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide

C20H33N3O — CID 120596832

IUPAC2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide
SMILESCCC1CCCN(C(C)(C)CNC(=O)C(C)(N)c2ccccc2)C1
InChIInChI=1S/C20H33N3O/c1-5-16-10-9-13-23(14-16)19(2,3)15-22-18(24)20(4,21)17-11-7-6-8-12-17/h6-8,11-12,16H,5,9-10,13-15,21H2,1-4H3,(H,22,24)
InChIKeyQZLCRRSGKNROON-UHFFFAOYSA-N
MW331.50 g/mol
LogP2.88
Rot. Bonds6

About 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide

2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide (PubChem CID 120596832) has the molecular formula C20H33N3O and a molecular weight of 331.50 g/mol. Its IUPAC name is 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide
PubChem CID120596832
Molecular FormulaC20H33N3O
Molecular Weight331.50 g/mol
Exact Mass331.26
IUPAC Name2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide
SMILESCCC1CCCN(C(C)(C)CNC(=O)C(C)(N)c2ccccc2)C1
InChIInChI=1S/C20H33N3O/c1-5-16-10-9-13-23(14-16)19(2,3)15-22-18(24)20(4,21)17-11-7-6-8-12-17/h6-8,11-12,16H,5,9-10,13-15,21H2,1-4H3,(H,22,24)
InChIKeyQZLCRRSGKNROON-UHFFFAOYSA-N
XLogP2.88
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.50
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-2-phenylpropanamide
CID 120595010
N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-(methylamino)acetamide
CID 120704469
3-hydroxy-N-[2-methyl-2-(3-methylpiperidin-1-yl)propyl]-3-phenylbutanamide
CID 110025007
1-[2-[(3R)-3-ethylpiperidin-1-yl]-2-methylpropyl]-3-(4-methylphenyl)urea
CID 95765182
2-amino-N-(2-cyclopentylethyl)-2-phenylpropanamide;hydrochloride
CID 120588835
5-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-methylbenzamide;dihydrochloride
CID 120646712
1-[2-[(3S)-3-ethylpiperidin-1-yl]-2-methylpropyl]-3-(pyridin-3-ylmethyl)urea
CID 95622001
2-amino-N-[(3-hydroxycyclohexyl)methyl]-2-phenylpropanamide
CID 106135154
(2R)-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]piperidine-2-carboxamide
CID 119884432
N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119884497
2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120800439
2-amino-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide;hydrochloride
CID 120588942

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide?
The IUPAC name of 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide (CID 120596832) is 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide is CCC1CCCN(C(C)(C)CNC(=O)C(C)(N)c2ccccc2)C1.
What is the InChIKey of 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide?
The InChIKey is QZLCRRSGKNROON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33N3O/c1-5-16-10-9-13-23(14-16)19(2,3)15-22-18(24)20(4,21)17-11-7-6-8-12-17/h6-8,11-12,16H,5,9-10,13-15,21H2,1-4H3,(H,22,24).
What are the key properties of 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide?
2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide has a molecular weight of 331.50 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-phenylpropanamide is sourced from PubChem (CID 120596832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).