2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide

C22H35N3O — CID 69492376

IUPAC2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide
SMILESCC(C)(CN1CCCC1)C1CCC(NC(=O)C(N)c2ccccc2)CC1
InChIInChI=1S/C22H35N3O/c1-22(2,16-25-14-6-7-15-25)18-10-12-19(13-11-18)24-21(26)20(23)17-8-4-3-5-9-17/h3-5,8-9,18-20H,6-7,10-16,23H2,1-2H3,(H,24,26)
InChIKeyOOWNACTXGYXIHU-UHFFFAOYSA-N
MW357.54 g/mol
LogP3.48
Rot. Bonds6

About 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide

2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide (PubChem CID 69492376) has the molecular formula C22H35N3O and a molecular weight of 357.54 g/mol. Its IUPAC name is 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide
PubChem CID69492376
Molecular FormulaC22H35N3O
Molecular Weight357.54 g/mol
Exact Mass357.28
IUPAC Name2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide
SMILESCC(C)(CN1CCCC1)C1CCC(NC(=O)C(N)c2ccccc2)CC1
InChIInChI=1S/C22H35N3O/c1-22(2,16-25-14-6-7-15-25)18-10-12-19(13-11-18)24-21(26)20(23)17-8-4-3-5-9-17/h3-5,8-9,18-20H,6-7,10-16,23H2,1-2H3,(H,24,26)
InChIKeyOOWNACTXGYXIHU-UHFFFAOYSA-N
XLogP3.48
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.54
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(1-ethylpiperidin-3-yl)-2-phenylacetamide
CID 61169816
(2S)-2-amino-2-phenyl-N-(1-propylpiperidin-4-yl)acetamide
CID 104897650
(2R)-2-amino-N-cycloheptyl-2-phenylacetamide
CID 61148121
2-amino-N-(4-aminocyclohexyl)-2-phenylacetamide
CID 62320729
2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide
CID 119278332
2-amino-2-phenyl-N-(1-prop-2-enylpiperidin-4-yl)acetamide
CID 119879084
(2S)-2-amino-N-(1-methylsulfonylpiperidin-4-yl)-2-phenylacetamide
CID 104897197
2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2-phenylacetamide;hydrochloride
CID 119278567
4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide
CID 56867282
2-amino-2-phenyl-N-piperidin-4-ylacetamide
CID 110463053
(2R)-2-amino-N-(3-methylcyclohexyl)-2-phenylacetamide
CID 61156405
2-amino-N-(2-cyclopentylethyl)-2-phenylacetamide;hydrochloride
CID 119289820

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide?
The IUPAC name of 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide (CID 69492376) is 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide?
The canonical SMILES for 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide is CC(C)(CN1CCCC1)C1CCC(NC(=O)C(N)c2ccccc2)CC1.
What is the InChIKey of 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide?
The InChIKey is OOWNACTXGYXIHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35N3O/c1-22(2,16-25-14-6-7-15-25)18-10-12-19(13-11-18)24-21(26)20(23)17-8-4-3-5-9-17/h3-5,8-9,18-20H,6-7,10-16,23H2,1-2H3,(H,24,26).
What are the key properties of 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide?
2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide has a molecular weight of 357.54 g/mol, XLogP of 3.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)cyclohexyl]-2-phenylacetamide is sourced from PubChem (CID 69492376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).