4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide

C16H24N4O2 — CID 56867282

IUPAC4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide
SMILESCCNC(=O)N1CCC(NC(=O)[C@H](N)c2ccccc2)CC1
InChIInChI=1S/C16H24N4O2/c1-2-18-16(22)20-10-8-13(9-11-20)19-15(21)14(17)12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,17H2,1H3,(H,18,22)(H,19,21)/t14-/m1/s1
InChIKeyYPJYNKVFLGBEPA-CQSZACIVSA-N
MW304.39 g/mol
LogP1.00
Rot. Bonds4

About 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide

4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide (PubChem CID 56867282) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide
PubChem CID56867282
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Name4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide
SMILESCCNC(=O)N1CCC(NC(=O)[C@H](N)c2ccccc2)CC1
InChIInChI=1S/C16H24N4O2/c1-2-18-16(22)20-10-8-13(9-11-20)19-15(21)14(17)12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,17H2,1H3,(H,18,22)(H,19,21)/t14-/m1/s1
InChIKeyYPJYNKVFLGBEPA-CQSZACIVSA-N
XLogP1.00
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-phenylacetamide
CID 119278332
(2S)-2-amino-2-phenyl-N-(1-propylpiperidin-4-yl)acetamide
CID 104897650
2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2-phenylacetamide;hydrochloride
CID 119278567
N-[1-[(2R)-2-amino-2-phenylacetyl]piperidin-4-yl]propanamide
CID 61163953
(2S)-2-amino-N-(1-methylsulfonylpiperidin-4-yl)-2-phenylacetamide
CID 104897197
(2R)-2-amino-N-(1-ethylpiperidin-3-yl)-2-phenylacetamide
CID 61169816
1-ethyl-3-[1-[(2R)-2-phenylbutanoyl]piperidin-4-yl]urea
CID 95303034
2-amino-N-ethyl-2-phenylacetamide
CID 22262703
2-amino-2-phenyl-N-piperidin-4-ylacetamide
CID 110463053
(2R)-2-amino-N-cycloheptyl-2-phenylacetamide
CID 61148121
2-amino-2-phenyl-N-(1-prop-2-enylpiperidin-4-yl)acetamide
CID 119879084
2-amino-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2-phenylacetamide;hydrochloride
CID 119277094

Frequently Asked Questions

What is the IUPAC name of 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide?
The IUPAC name of 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide (CID 56867282) is 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide?
The canonical SMILES for 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide is CCNC(=O)N1CCC(NC(=O)[C@H](N)c2ccccc2)CC1.
What is the InChIKey of 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide?
The InChIKey is YPJYNKVFLGBEPA-CQSZACIVSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-2-18-16(22)20-10-8-13(9-11-20)19-15(21)14(17)12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,17H2,1H3,(H,18,22)(H,19,21)/t14-/m1/s1.
What are the key properties of 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide?
4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 1.00, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2R)-2-amino-2-phenylacetyl]amino]-N-ethylpiperidine-1-carboxamide is sourced from PubChem (CID 56867282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).