2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide

C16H22N2O — CID 55232631

IUPAC2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide
SMILESNC(C(=O)NCC1CC2CCC1C2)c1ccccc1
InChIInChI=1S/C16H22N2O/c17-15(12-4-2-1-3-5-12)16(19)18-10-14-9-11-6-7-13(14)8-11/h1-5,11,13-15H,6-10,17H2,(H,18,19)
InChIKeyYOBKVPPBVZHTKP-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.24
Rot. Bonds4

About 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide

2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide (PubChem CID 55232631) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide
PubChem CID55232631
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide
SMILESNC(C(=O)NCC1CC2CCC1C2)c1ccccc1
InChIInChI=1S/C16H22N2O/c17-15(12-4-2-1-3-5-12)16(19)18-10-14-9-11-6-7-13(14)8-11/h1-5,11,13-15H,6-10,17H2,(H,18,19)
InChIKeyYOBKVPPBVZHTKP-UHFFFAOYSA-N
XLogP2.24
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-phenylpropanamide
CID 63683495
3-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-phenylpropanamide;hydrochloride
CID 119950772
1-(2-bicyclo[2.2.1]heptanylmethyl)-3-phenylurea
CID 4682793
4-amino-5-(2-bicyclo[2.2.1]heptanylmethylamino)-5-oxopentanoic acid
CID 64888968
2-(2-bicyclo[2.2.1]heptanylmethylamino)-1-phenylethanol
CID 63681601
(2R)-2-amino-N-[(3-methylcyclohexyl)methyl]-2-phenylacetamide
CID 103795876
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-chloropropanamide
CID 63683466
1-N-[[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]methyl]-3-N-[[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]methyl]benzene-1,3-dicarboxamide
CID 98155306
2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide
CID 63684003
2-amino-N-[2-(2-methylcyclohexyl)ethyl]-2-phenylacetamide
CID 119323339
3-[[2-(2-bicyclo[2.2.1]heptanyl)acetyl]amino]-2-phenylpropanoic acid
CID 119254834
1-[[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]methyl]-3-phenylthiourea
CID 40547896

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide?
The IUPAC name of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide (CID 55232631) is 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide?
The canonical SMILES for 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide is NC(C(=O)NCC1CC2CCC1C2)c1ccccc1.
What is the InChIKey of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide?
The InChIKey is YOBKVPPBVZHTKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c17-15(12-4-2-1-3-5-12)16(19)18-10-14-9-11-6-7-13(14)8-11/h1-5,11,13-15H,6-10,17H2,(H,18,19).
What are the key properties of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide?
2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide has a molecular weight of 258.36 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide is sourced from PubChem (CID 55232631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).